potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide

C193H219BBr9Cl5F10IKN25NaO29S — CID 167609407

IUPACpotassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide
SMILESC.CC(=O)NC1CC2c3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(Br)c3N(C(C)C)C2C1.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N=[N+]=[N-])CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(O)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(OS(C)(=O)=O)CC21.CC(C)N1c2c(Br)cc(C(=O)O)cc2C2CC(O)CC21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC(O)CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC=CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CCC(I)C1N2C(C)C.COc1ccc(N)cc1.[K+].[N-]=[N+]=[N-].[Na+].[OH-]
InChIInChI=1S/C24H25BrClF2N3O3.C23H24BrClF2N2O5S.C22H21BrClF2N5O2.C22H23BrClF2N3O2.C22H22BrClF2N2O3.C16H19BrINO2.C16H20BrNO3.C16H18BrNO2.C15H18BrNO3.C9H15BN2O2.C7H9NO.CH4.K.N3.Na.H2O/c1-12(2)31-21-11-16(29-13(3)32)10-18(21)19-8-14(9-20(25)22(19)31)23(33)30-15-4-6-17(7-5-15)34-24(26,27)28;1-12(2)29-20-11-16(34-35(3,31)32)10-17(20)18-8-13(9-19(24)21(18)29)22(30)28-14-4-6-15(7-5-14)33-23(25,26)27;1-11(2)31-19-10-14(29-30-27)9-16(19)17-7-12(8-18(23)20(17)31)21(32)28-13-3-5-15(6-4-13)33-22(24,25)26;1-11(2)29-19-10-13(27)9-16(19)17-7-12(8-18(23)20(17)29)21(30)28-14-3-5-15(6-4-14)31-22(24,25)26;1-11(2)28-19-10-14(29)9-16(19)17-7-12(8-18(23)20(17)28)21(30)27-13-3-5-15(6-4-13)31-22(24,25)26;1-8(2)19-14-11(10-4-5-13(18)15(10)19)6-9(7-12(14)17)16(20)21-3;1-8(2)18-14-7-10(19)6-11(14)12-4-9(16(20)21-3)5-13(17)15(12)18;1-9(2)18-14-6-4-5-11(14)12-7-10(16(19)20-3)8-13(17)15(12)18;1-7(2)17-13-6-9(18)5-10(13)11-3-8(15(19)20)4-12(16)14(11)17;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;1-9-7-4-2-6(8)3-5-7;;;1-3-2;;/h4-9,12,16,18,21H,10-11H2,1-3H3,(H,29,32)(H,30,33);4-9,12,16-17,20H,10-11H2,1-3H3,(H,28,30);3-8,11,14,16,19H,9-10H2,1-2H3,(H,28,32);3-8,11,13,16,19H,9-10,27H2,1-2H3,(H,28,30);3-8,11,14,16,19,29H,9-10H2,1-2H3,(H,27,30);6-8,10,13,15H,4-5H2,1-3H3;4-5,8,10-11,14,19H,6-7H2,1-3H3;4,6-9,11,14H,5H2,1-3H3;3-4,7,9-10,13,18H,5-6H2,1-2H3,(H,19,20);5-6H,1-4H3,(H,11,12);2-5H,8H2,1H3;1H4;;;;1H2/q;;;;;;;;;;;;+1;-1;+1;/p-1
InChIKeyVDPWDZRNIYOWPM-UHFFFAOYSA-M
MW4671.27 g/mol
LogP41.70
Rot. Bonds39

About potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide

potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide (PubChem CID 167609407) has the molecular formula C193H219BBr9Cl5F10IKN25NaO29S and a molecular weight of 4671.27 g/mol. Its IUPAC name is potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide.

Molecular Properties

Compound Namepotassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide
PubChem CID167609407
Molecular FormulaC193H219BBr9Cl5F10IKN25NaO29S
Molecular Weight4671.27 g/mol
Exact Mass4657.58
IUPAC Namepotassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide
SMILESC.CC(=O)NC1CC2c3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(Br)c3N(C(C)C)C2C1.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N=[N+]=[N-])CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(O)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(OS(C)(=O)=O)CC21.CC(C)N1c2c(Br)cc(C(=O)O)cc2C2CC(O)CC21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC(O)CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC=CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CCC(I)C1N2C(C)C.COc1ccc(N)cc1.[K+].[N-]=[N+]=[N-].[Na+].[OH-]
InChIInChI=1S/C24H25BrClF2N3O3.C23H24BrClF2N2O5S.C22H21BrClF2N5O2.C22H23BrClF2N3O2.C22H22BrClF2N2O3.C16H19BrINO2.C16H20BrNO3.C16H18BrNO2.C15H18BrNO3.C9H15BN2O2.C7H9NO.CH4.K.N3.Na.H2O/c1-12(2)31-21-11-16(29-13(3)32)10-18(21)19-8-14(9-20(25)22(19)31)23(33)30-15-4-6-17(7-5-15)34-24(26,27)28;1-12(2)29-20-11-16(34-35(3,31)32)10-17(20)18-8-13(9-19(24)21(18)29)22(30)28-14-4-6-15(7-5-14)33-23(25,26)27;1-11(2)31-19-10-14(29-30-27)9-16(19)17-7-12(8-18(23)20(17)31)21(32)28-13-3-5-15(6-4-13)33-22(24,25)26;1-11(2)29-19-10-13(27)9-16(19)17-7-12(8-18(23)20(17)29)21(30)28-14-3-5-15(6-4-14)31-22(24,25)26;1-11(2)28-19-10-14(29)9-16(19)17-7-12(8-18(23)20(17)28)21(30)27-13-3-5-15(6-4-13)31-22(24,25)26;1-8(2)19-14-11(10-4-5-13(18)15(10)19)6-9(7-12(14)17)16(20)21-3;1-8(2)18-14-7-10(19)6-11(14)12-4-9(16(20)21-3)5-13(17)15(12)18;1-9(2)18-14-6-4-5-11(14)12-7-10(16(19)20-3)8-13(17)15(12)18;1-7(2)17-13-6-9(18)5-10(13)11-3-8(15(19)20)4-12(16)14(11)17;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;1-9-7-4-2-6(8)3-5-7;;;1-3-2;;/h4-9,12,16,18,21H,10-11H2,1-3H3,(H,29,32)(H,30,33);4-9,12,16-17,20H,10-11H2,1-3H3,(H,28,30);3-8,11,14,16,19H,9-10H2,1-2H3,(H,28,32);3-8,11,13,16,19H,9-10,27H2,1-2H3,(H,28,30);3-8,11,14,16,19,29H,9-10H2,1-2H3,(H,27,30);6-8,10,13,15H,4-5H2,1-3H3;4-5,8,10-11,14,19H,6-7H2,1-3H3;4,6-9,11,14H,5H2,1-3H3;3-4,7,9-10,13,18H,5-6H2,1-2H3,(H,19,20);5-6H,1-4H3,(H,11,12);2-5H,8H2,1H3;1H4;;;;1H2/q;;;;;;;;;;;;+1;-1;+1;/p-1
InChIKeyVDPWDZRNIYOWPM-UHFFFAOYSA-M
XLogP41.70
TPSA716.04 Ų
H-Bond Donors13
H-Bond Acceptors41
Rotatable Bonds39
Heavy Atoms276
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004671.27
LogP ≤ 541.70
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1041

Analyze potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide with MolForge

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What is the IUPAC name of potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide?
The IUPAC name of potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide (CID 167609407) is potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide.
What is the SMILES notation for potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide?
The canonical SMILES for potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide is C.CC(=O)NC1CC2c3cc(C(=O)Nc4ccc(OC(F)(F)Cl)cc4)cc(Br)c3N(C(C)C)C2C1.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(N=[N+]=[N-])CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(O)CC21.CC(C)N1c2c(Br)cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2C2CC(OS(C)(=O)=O)CC21.CC(C)N1c2c(Br)cc(C(=O)O)cc2C2CC(O)CC21.CC1(C)OB(c2ccn[nH]2)OC1(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC(O)CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CC=CC1N2C(C)C.COC(=O)c1cc(Br)c2c(c1)C1CCC(I)C1N2C(C)C.COc1ccc(N)cc1.[K+].[N-]=[N+]=[N-].[Na+].[OH-].
What is the InChIKey of potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide?
The InChIKey is VDPWDZRNIYOWPM-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H25BrClF2N3O3.C23H24BrClF2N2O5S.C22H21BrClF2N5O2.C22H23BrClF2N3O2.C22H22BrClF2N2O3.C16H19BrINO2.C16H20BrNO3.C16H18BrNO2.C15H18BrNO3.C9H15BN2O2.C7H9NO.CH4.K.N3.Na.H2O/c1-12(2)31-21-11-16(29-13(3)32)10-18(21)19-8-14(9-20(25)22(19)31)23(33)30-15-4-6-17(7-5-15)34-24(26,27)28;1-12(2)29-20-11-16(34-35(3,31)32)10-17(20)18-8-13(9-19(24)21(18)29)22(30)28-14-4-6-15(7-5-14)33-23(25,26)27;1-11(2)31-19-10-14(29-30-27)9-16(19)17-7-12(8-18(23)20(17)31)21(32)28-13-3-5-15(6-4-13)33-22(24,25)26;1-11(2)29-19-10-13(27)9-16(19)17-7-12(8-18(23)20(17)29)21(30)28-14-3-5-15(6-4-14)31-22(24,25)26;1-11(2)28-19-10-14(29)9-16(19)17-7-12(8-18(23)20(17)28)21(30)27-13-3-5-15(6-4-13)31-22(24,25)26;1-8(2)19-14-11(10-4-5-13(18)15(10)19)6-9(7-12(14)17)16(20)21-3;1-8(2)18-14-7-10(19)6-11(14)12-4-9(16(20)21-3)5-13(17)15(12)18;1-9(2)18-14-6-4-5-11(14)12-7-10(16(19)20-3)8-13(17)15(12)18;1-7(2)17-13-6-9(18)5-10(13)11-3-8(15(19)20)4-12(16)14(11)17;1-8(2)9(3,4)14-10(13-8)7-5-6-11-12-7;1-9-7-4-2-6(8)3-5-7;;;1-3-2;;/h4-9,12,16,18,21H,10-11H2,1-3H3,(H,29,32)(H,30,33);4-9,12,16-17,20H,10-11H2,1-3H3,(H,28,30);3-8,11,14,16,19H,9-10H2,1-2H3,(H,28,32);3-8,11,13,16,19H,9-10,27H2,1-2H3,(H,28,30);3-8,11,14,16,19,29H,9-10H2,1-2H3,(H,27,30);6-8,10,13,15H,4-5H2,1-3H3;4-5,8,10-11,14,19H,6-7H2,1-3H3;4,6-9,11,14H,5H2,1-3H3;3-4,7,9-10,13,18H,5-6H2,1-2H3,(H,19,20);5-6H,1-4H3,(H,11,12);2-5H,8H2,1H3;1H4;;;;1H2/q;;;;;;;;;;;;+1;-1;+1;/p-1.
What are the key properties of potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide?
potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide has a molecular weight of 4671.27 g/mol, XLogP of 41.70, 39 rotatable bonds, 13 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sodium;2-acetamido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-amino-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;2-azido-5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;[5-bromo-7-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indol-2-yl] methanesulfonate;5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxamide;5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylic acid;methane;4-methoxyaniline;methyl 5-bromo-2-hydroxy-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-3-iodo-4-propan-2-yl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole-7-carboxylate;methyl 5-bromo-4-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]indole-7-carboxylate;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;azide;hydroxide is sourced from PubChem (CID 167609407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).