tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide

C360H182BCl4F3I5K3N31NaO17Si4 — CID 161262954

IUPACtripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide
SMILESC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C1COCCN1.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCN(C(C)C)C(C)C.C[Si](C)(C)CCOCCl.II.N#Cc1cccc(B(O)O)c1.O=CC(F)(F)F.O=CO[O-].[C-]#[N+]c1cnc2[nH]cc(-c3cccc(C#N)c3)c2c1N1CCOCC1.[C-]#[N+]c1cnc2[nH]cc(I)c2c1Cl.[C-]#[N+]c1cnc2[nH]ccc2c1Cl.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2CO)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1Cl.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[H-].[H-].[K+].[K+].[K+].[Na+].[OH-]
InChIInChI=1S/C46H2.C45H4.C44H6.C43H4.C42H2.C25H29N5O2Si.C20H17N5O2.C19H15N5O.C18H25IN4O2Si.C14H17ClIN3OSi.C8H3ClIN3.C8H4ClN3.C8H19N.C7H6BNO2.C6H15ClOSi.C4H9NO.C2HF3O.CH2O3.I2.3K.Na.H2O.2H/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-27-22-16-28-25-23(24(22)29-8-10-31-11-9-29)21(20-7-5-6-19(14-20)15-26)17-30(25)18-32-12-13-33(2,3)4;1-22-17-11-23-20-18(19(17)24-5-7-27-8-6-24)16(12-25(20)13-26)15-4-2-3-14(9-15)10-21;1-21-16-12-23-19-17(18(16)24-5-7-25-8-6-24)15(11-22-19)14-4-2-3-13(9-14)10-20;1-20-15-11-21-18-16(17(15)22-5-7-24-8-6-22)14(19)12-23(18)13-25-9-10-26(2,3)4;1-17-11-7-18-14-12(13(11)15)10(16)8-19(14)9-20-5-6-21(2,3)4;1-11-5-3-13-8-6(7(5)9)4(10)2-12-8;1-10-6-4-12-8-5(7(6)9)2-3-11-8;1-6-9(7(2)3)8(4)5;9-5-6-2-1-3-7(4-6)8(10)11;1-9(2,3)5-4-8-6-7;1-3-6-4-2-5-1;3-2(4,5)1-6;2-1-4-3;1-2;;;;;;;/h1-2H;1H,2H3;1-2H3;1H,2H3;1-2H;5-7,14,16-17H,8-13,18H2,2-4H3;2-4,9,11-12,26H,5-8,13H2;2-4,9,11-12H,5-8H2,(H,22,23);11-12H,5-10,13H2,2-4H3;7-8H,5-6,9H2,2-4H3;2-3H,(H,12,13);2-4H,(H,11,12);7-8H,6H2,1-5H3;1-4,10-11H;4-6H2,1-3H3;5H,1-4H2;1H;1,3H;;;;;;1H2;;/q;;;;;;;;;;;;;;;;;;;4*+1;;2*-1/p-2
InChIKeySREWIWXVVNRZOM-UHFFFAOYSA-L
MW6310.38 g/mol
LogP22.99
Rot. Bonds32

About tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide

tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide (PubChem CID 161262954) has the molecular formula C360H182BCl4F3I5K3N31NaO17Si4 and a molecular weight of 6310.38 g/mol. Its IUPAC name is tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide.

Molecular Properties

Compound Nametripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide
PubChem CID161262954
Molecular FormulaC360H182BCl4F3I5K3N31NaO17Si4
Molecular Weight6310.38 g/mol
Exact Mass6303.62
IUPAC Nametripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide
SMILESC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C1COCCN1.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCN(C(C)C)C(C)C.C[Si](C)(C)CCOCCl.II.N#Cc1cccc(B(O)O)c1.O=CC(F)(F)F.O=CO[O-].[C-]#[N+]c1cnc2[nH]cc(-c3cccc(C#N)c3)c2c1N1CCOCC1.[C-]#[N+]c1cnc2[nH]cc(I)c2c1Cl.[C-]#[N+]c1cnc2[nH]ccc2c1Cl.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2CO)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1Cl.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[H-].[H-].[K+].[K+].[K+].[Na+].[OH-]
InChIInChI=1S/C46H2.C45H4.C44H6.C43H4.C42H2.C25H29N5O2Si.C20H17N5O2.C19H15N5O.C18H25IN4O2Si.C14H17ClIN3OSi.C8H3ClIN3.C8H4ClN3.C8H19N.C7H6BNO2.C6H15ClOSi.C4H9NO.C2HF3O.CH2O3.I2.3K.Na.H2O.2H/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-27-22-16-28-25-23(24(22)29-8-10-31-11-9-29)21(20-7-5-6-19(14-20)15-26)17-30(25)18-32-12-13-33(2,3)4;1-22-17-11-23-20-18(19(17)24-5-7-27-8-6-24)16(12-25(20)13-26)15-4-2-3-14(9-15)10-21;1-21-16-12-23-19-17(18(16)24-5-7-25-8-6-24)15(11-22-19)14-4-2-3-13(9-14)10-20;1-20-15-11-21-18-16(17(15)22-5-7-24-8-6-22)14(19)12-23(18)13-25-9-10-26(2,3)4;1-17-11-7-18-14-12(13(11)15)10(16)8-19(14)9-20-5-6-21(2,3)4;1-11-5-3-13-8-6(7(5)9)4(10)2-12-8;1-10-6-4-12-8-5(7(6)9)2-3-11-8;1-6-9(7(2)3)8(4)5;9-5-6-2-1-3-7(4-6)8(10)11;1-9(2,3)5-4-8-6-7;1-3-6-4-2-5-1;3-2(4,5)1-6;2-1-4-3;1-2;;;;;;;/h1-2H;1H,2H3;1-2H3;1H,2H3;1-2H;5-7,14,16-17H,8-13,18H2,2-4H3;2-4,9,11-12,26H,5-8,13H2;2-4,9,11-12H,5-8H2,(H,22,23);11-12H,5-10,13H2,2-4H3;7-8H,5-6,9H2,2-4H3;2-3H,(H,12,13);2-4H,(H,11,12);7-8H,6H2,1-5H3;1-4,10-11H;4-6H2,1-3H3;5H,1-4H2;1H;1,3H;;;;;;1H2;;/q;;;;;;;;;;;;;;;;;;;4*+1;;2*-1/p-2
InChIKeySREWIWXVVNRZOM-UHFFFAOYSA-L
XLogP22.99
TPSA551.42 Ų
H-Bond Donors7
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms429
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006310.38
LogP ≤ 522.99
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1038

Analyze tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide with MolForge

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Frequently Asked Questions

What is the IUPAC name of tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide?
The IUPAC name of tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide (CID 161262954) is tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide.
What is the SMILES notation for tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide?
The canonical SMILES for tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide is C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C.C1COCCN1.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCN(C(C)C)C(C)C.C[Si](C)(C)CCOCCl.II.N#Cc1cccc(B(O)O)c1.O=CC(F)(F)F.O=CO[O-].[C-]#[N+]c1cnc2[nH]cc(-c3cccc(C#N)c3)c2c1N1CCOCC1.[C-]#[N+]c1cnc2[nH]cc(I)c2c1Cl.[C-]#[N+]c1cnc2[nH]ccc2c1Cl.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2CO)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(-c3cccc(C#N)c3)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1Cl.[C-]#[N+]c1cnc2c(c(I)cn2COCC[Si](C)(C)C)c1N1CCOCC1.[H-].[H-].[K+].[K+].[K+].[Na+].[OH-].
What is the InChIKey of tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide?
The InChIKey is SREWIWXVVNRZOM-UHFFFAOYSA-L. The full InChI is InChI=1S/C46H2.C45H4.C44H6.C43H4.C42H2.C25H29N5O2Si.C20H17N5O2.C19H15N5O.C18H25IN4O2Si.C14H17ClIN3OSi.C8H3ClIN3.C8H4ClN3.C8H19N.C7H6BNO2.C6H15ClOSi.C4H9NO.C2HF3O.CH2O3.I2.3K.Na.H2O.2H/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-27-22-16-28-25-23(24(22)29-8-10-31-11-9-29)21(20-7-5-6-19(14-20)15-26)17-30(25)18-32-12-13-33(2,3)4;1-22-17-11-23-20-18(19(17)24-5-7-27-8-6-24)16(12-25(20)13-26)15-4-2-3-14(9-15)10-21;1-21-16-12-23-19-17(18(16)24-5-7-25-8-6-24)15(11-22-19)14-4-2-3-13(9-14)10-20;1-20-15-11-21-18-16(17(15)22-5-7-24-8-6-22)14(19)12-23(18)13-25-9-10-26(2,3)4;1-17-11-7-18-14-12(13(11)15)10(16)8-19(14)9-20-5-6-21(2,3)4;1-11-5-3-13-8-6(7(5)9)4(10)2-12-8;1-10-6-4-12-8-5(7(6)9)2-3-11-8;1-6-9(7(2)3)8(4)5;9-5-6-2-1-3-7(4-6)8(10)11;1-9(2,3)5-4-8-6-7;1-3-6-4-2-5-1;3-2(4,5)1-6;2-1-4-3;1-2;;;;;;;/h1-2H;1H,2H3;1-2H3;1H,2H3;1-2H;5-7,14,16-17H,8-13,18H2,2-4H3;2-4,9,11-12,26H,5-8,13H2;2-4,9,11-12H,5-8H2,(H,22,23);11-12H,5-10,13H2,2-4H3;7-8H,5-6,9H2,2-4H3;2-3H,(H,12,13);2-4H,(H,11,12);7-8H,6H2,1-5H3;1-4,10-11H;4-6H2,1-3H3;5H,1-4H2;1H;1,3H;;;;;;1H2;;/q;;;;;;;;;;;;;;;;;;;4*+1;;2*-1/p-2.
What are the key properties of tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide?
tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide has a molecular weight of 6310.38 g/mol, XLogP of 22.99, 32 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;sodium;4-chloro-3-iodo-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-[(4-chloro-3-iodo-5-isocyanopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;4-chloro-5-isocyano-1H-pyrrolo[2,3-b]pyridine;2-(chloromethoxy)ethyl-trimethylsilane;(3-cyanophenyl)boronic acid;dotetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;N-ethyl-N-propan-2-ylpropan-2-amine;hexatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45-tricosayne;hydride;3-[1-(hydroxymethyl)-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-3-yl]benzonitrile;2-[(3-iodo-5-isocyano-4-morpholin-4-ylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-(5-isocyano-4-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzonitrile;3-[5-isocyano-4-morpholin-4-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]benzonitrile;molecular iodine;morpholine;oxido formate;pentatetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43-docosayne;tetratetraconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42-henicosayne;2,2,2-trifluoroacetaldehyde;tritetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41-henicosayne;hydroxide is sourced from PubChem (CID 161262954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).