1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide

C173H152F15N11O25S6 — CID 159520349

IUPAC1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide
SMILESC=C[n+]1ccn(COc2ccc(C3(c4ccc(OCn5cc[n+](C=C)c5)cc4)c4cc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)ccc4-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)cc2)c1.C=Cn1c(C)c(C)[n+](C=C)c1Cc1ccc(C2c3ccc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3C3(c4cc(C(c5ccc(C)cc5)c5ccc(OC)cc5)ccc4-c4ccc(C(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)c3cc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc32)cc1.CS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C102H91N2O7.C65H58N6O6.2C2F6NO4S2.C2H3F3NO4S2/c1-13-103-65(4)66(5)104(14-2)96(103)59-67-17-21-76(22-18-67)101-90-57-39-79(99(72-29-47-84(108-9)48-30-72)73-31-49-85(109-10)50-32-73)62-94(90)102(95-63-80(40-58-91(95)101)100(74-33-51-86(110-11)52-34-74)75-35-53-87(111-12)54-36-75)92-60-77(97(68-19-15-64(3)16-20-68)69-23-41-81(105-6)42-24-69)37-55-88(92)89-56-38-78(61-93(89)102)98(70-25-43-82(106-7)44-26-70)71-27-45-83(107-8)46-28-71;1-7-66-37-39-68(43-66)45-76-59-23-9-47(10-24-59)65(48-11-25-60(26-12-48)77-46-69-40-38-67(8-2)44-69)63-41-53(70(49-13-27-55(72-3)28-14-49)50-15-29-56(73-4)30-16-50)21-35-61(63)62-36-22-54(42-64(62)65)71(51-17-31-57(74-5)32-18-51)52-19-33-58(75-6)34-20-52;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;1-11(7,8)6-12(9,10)2(3,4)5/h13-58,60-63,97-101H,1-2,59H2,3-12H3;7-44H,1-2,45-46H2,3-6H3;;;1H3/q+1;+2;3*-1
InChIKeyVKLYLXASTSSESX-UHFFFAOYSA-N
MW3262.54 g/mol
LogP37.89
Rot. Bonds50

About 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide

1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide (PubChem CID 159520349) has the molecular formula C173H152F15N11O25S6 and a molecular weight of 3262.54 g/mol. Its IUPAC name is 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide.

Molecular Properties

Compound Name1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide
PubChem CID159520349
Molecular FormulaC173H152F15N11O25S6
Molecular Weight3262.54 g/mol
Exact Mass3259.90
IUPAC Name1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide
SMILESC=C[n+]1ccn(COc2ccc(C3(c4ccc(OCn5cc[n+](C=C)c5)cc4)c4cc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)ccc4-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)cc2)c1.C=Cn1c(C)c(C)[n+](C=C)c1Cc1ccc(C2c3ccc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3C3(c4cc(C(c5ccc(C)cc5)c5ccc(OC)cc5)ccc4-c4ccc(C(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)c3cc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc32)cc1.CS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C102H91N2O7.C65H58N6O6.2C2F6NO4S2.C2H3F3NO4S2/c1-13-103-65(4)66(5)104(14-2)96(103)59-67-17-21-76(22-18-67)101-90-57-39-79(99(72-29-47-84(108-9)48-30-72)73-31-49-85(109-10)50-32-73)62-94(90)102(95-63-80(40-58-91(95)101)100(74-33-51-86(110-11)52-34-74)75-35-53-87(111-12)54-36-75)92-60-77(97(68-19-15-64(3)16-20-68)69-23-41-81(105-6)42-24-69)37-55-88(92)89-56-38-78(61-93(89)102)98(70-25-43-82(106-7)44-26-70)71-27-45-83(107-8)46-28-71;1-7-66-37-39-68(43-66)45-76-59-23-9-47(10-24-59)65(48-11-25-60(26-12-48)77-46-69-40-38-67(8-2)44-69)63-41-53(70(49-13-27-55(72-3)28-14-49)50-15-29-56(73-4)30-16-50)21-35-61(63)62-36-22-54(42-64(62)65)71(51-17-31-57(74-5)32-18-51)52-19-33-58(75-6)34-20-52;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;1-11(7,8)6-12(9,10)2(3,4)5/h13-58,60-63,97-101H,1-2,59H2,3-12H3;7-44H,1-2,45-46H2,3-6H3;;;1H3/q+1;+2;3*-1
InChIKeyVKLYLXASTSSESX-UHFFFAOYSA-N
XLogP37.89
TPSA400.04 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds50
Heavy Atoms230
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003262.54
LogP ≤ 537.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide with MolForge

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Related Compounds

9-[[3,5-bis[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]-2-N,7-N-bis(4-methoxyphenyl)-2-N,7-N-di(spiro[fluorene-9,9'-xanthene]-2-yl)carbazole-2,7-diamine;[4-[[2-[bis(4-methoxyphenyl)methyl]-7'-[[4-[(3-ethylimidazol-3-ium-1-yl)methoxymethyl]phenyl]-(4-methylphenyl)methyl]-7-[[4-(hydroxymethyl)phenyl]-(4-methoxyphenyl)methyl]spiro[fluorene-9,9'-xanthene]-2'-yl]-[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]methyl]phenyl]methanol;bis(methylsulfonyl)azanide;tris(methylsulfonyl(trifluoromethylsulfonyl)azanide)
CID 157071154
[4-[[10-[4-[[1,3-bis(ethenyl)-4,5-dimethylimidazol-1-ium-2-yl]methyl]phenyl]-2'-[bis(4-methoxyphenyl)methyl]-7'-[[4-(hydroxymethyl)phenyl]-(4-methoxyphenyl)methyl]-7-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[10H-anthracene-9,9'-fluorene]-2-yl]-(4-methoxyphenyl)methyl]phenyl]methanol;[4-[N-[9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-7-(4-methoxy-N-(4-methoxyphenyl)anilino)fluoren-2-yl]-4-(hydroxymethyl)anilino]phenyl]methanol;bis(methylsulfonyl)azanide;bis(methylsulfonyl(trifluoromethylsulfonyl)azanide)
CID 157221311
9-[[4-[[1,3-bis(ethenyl)-4,5-dimethylimidazol-1-ium-2-yl]methyl]phenyl]methyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine;tris(bis(trifluoromethylsulfonyl)azanide);3-N-[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]-2-[4-(methoxymethyl)phenyl]phenyl]-6-N-[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]-9-[(4-ethenylphenyl)methyl]-6-N-[4-(methoxymethyl)phenyl]carbazole-3,6-diamine
CID 157415901
9-[2-[3-[[4-[[3-[2-[3,6-bis(4-methoxy-N-(4-methoxyphenyl)anilino)carbazol-9-yl]ethyl]imidazol-3-ium-1-yl]methyl]phenyl]methyl]imidazol-1-ium-1-yl]ethyl]-3-N,6-N,6-N-tris(4-methoxyphenyl)-3-N-(4-methylphenyl)carbazole-3,6-diamine;methane;bis(1,1,1-trifluoro-N-methylsulfonylmethanesulfonamide)
CID 158969340
9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;[4-[[2-[bis(4-methoxyphenyl)methyl]-7'-[[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]-(4-methylphenyl)methyl]-7-[[4-(hydroxymethyl)phenyl]-(4-methoxyphenyl)methyl]spiro[fluorene-9,9'-xanthene]-2'-yl]-[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]methyl]phenyl]methanol;methane;N-methylsulfonylmethanesulfonamide;tris(1,1,1-trifluoro-N-methylsulfonylmethanesulfonamide)
CID 159177854
3-N,6-N-bis(4-ethenylphenyl)-9-[4-[(3-ethylimidazol-3-ium-1-yl)methyl]phenyl]-3-N,6-N-bis(4-methoxyphenyl)carbazole-3,6-diamine;bis(bis(trifluoromethylsulfonyl)azanide);9-[[4-[[3-[(4-ethenylphenyl)methyl]imidazol-3-ium-1-yl]methyl]phenyl]methyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine
CID 159282306
9-[[3,5-bis[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]-2-N,7-N-bis(4-methoxyphenyl)-2-N,7-N-di(spiro[fluorene-9,9'-xanthene]-2-yl)carbazole-2,7-diamine;9-[2-[3-[[4-[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]imidazol-1-ium-1-yl]ethyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine;methane;1,1,1-trifluoro-N-methylsulfonylmethanesulfonamide;1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 159764233
9-[[3,5-bis[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]-2-N,7-N-bis(4-methoxyphenyl)-2-N,7-N-di(spiro[fluorene-9,9'-xanthene]-2-yl)carbazole-2,7-diamine;[4-[[2-[bis(4-methoxyphenyl)methyl]-7'-[[4-[(3-ethylimidazol-3-ium-1-yl)methoxymethyl]phenyl]-(4-methylphenyl)methyl]-7-[[4-(hydroxymethyl)phenyl]-(4-methoxyphenyl)methyl]spiro[fluorene-9,9'-xanthene]-2'-yl]-[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]methyl]phenyl]methanol;bis(methylsulfonyl)azanide;methane;tris(methylsulfonyl(trifluoromethylsulfonyl)azanide)
CID 160707335
1-[[4-[[2,7-bis[bis(4-methoxyphenyl)methyl]-7'-[[4-[(3-ethenylimidazol-3-ium-1-yl)methoxymethyl]phenyl]-(4-methoxyphenyl)methyl]spiro[fluorene-9,9'-xanthene]-2'-yl]-(4-methylphenyl)methyl]phenyl]methoxymethyl]-3-ethenylimidazol-3-ium;9-[[3,5-bis[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]-2-N,7-N-bis(4-methoxyphenyl)-2-N,7-N-di(spiro[fluorene-9,9'-xanthene]-2-yl)carbazole-2,7-diamine;tetrakis(bis(trifluoromethylsulfonyl)azanide)
CID 160787397
3-N,6-N-bis(4-ethenylphenyl)-9-[4-[(3-ethylimidazol-3-ium-1-yl)methyl]phenyl]-3-N,6-N-bis(4-methoxyphenyl)carbazole-3,6-diamine;9-[[4-[[3-[(4-ethenylphenyl)methyl]imidazol-3-ium-1-yl]methyl]phenyl]methyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine;methane;bis(1,1,1-trifluoro-N-methylsulfonylmethanesulfonamide)
CID 160799742
9-[2-[3-[[4-[[3-[2-[3,6-bis(4-methoxy-N-(4-methoxyphenyl)anilino)carbazol-9-yl]ethyl]imidazol-3-ium-1-yl]methyl]phenyl]methyl]imidazol-1-ium-1-yl]ethyl]-3-N,6-N,6-N-tris(4-methoxyphenyl)-3-N-(4-methylphenyl)carbazole-3,6-diamine;bis(bis(trifluoromethylsulfonyl)azanide);9-[2-[3-[[4-[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]imidazol-1-ium-1-yl]ethyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine
CID 161033043
9-[[3,5-bis[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]-2-N,7-N-bis(4-methoxyphenyl)-2-N,7-N-di(spiro[fluorene-9,9'-xanthene]-2-yl)carbazole-2,7-diamine;9-[2-[3-[[4-[(3-ethenylimidazol-3-ium-1-yl)methyl]phenyl]methyl]imidazol-1-ium-1-yl]ethyl]-3-N,3-N,6-N,6-N-tetrakis(4-methoxyphenyl)carbazole-3,6-diamine;methane;bis(N-methylsulfonylmethanesulfonamide);bis(1,1,1-trifluoro-N-methylsulfonylmethanesulfonamide)
CID 161457090

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide?
The IUPAC name of 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide (CID 159520349) is 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide.
What is the SMILES notation for 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide?
The canonical SMILES for 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide is C=C[n+]1ccn(COc2ccc(C3(c4ccc(OCn5cc[n+](C=C)c5)cc4)c4cc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)ccc4-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)cc2)c1.C=Cn1c(C)c(C)[n+](C=C)c1Cc1ccc(C2c3ccc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3C3(c4cc(C(c5ccc(C)cc5)c5ccc(OC)cc5)ccc4-c4ccc(C(c5ccc(OC)cc5)c5ccc(OC)cc5)cc43)c3cc(C(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc32)cc1.CS(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide?
The InChIKey is VKLYLXASTSSESX-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H91N2O7.C65H58N6O6.2C2F6NO4S2.C2H3F3NO4S2/c1-13-103-65(4)66(5)104(14-2)96(103)59-67-17-21-76(22-18-67)101-90-57-39-79(99(72-29-47-84(108-9)48-30-72)73-31-49-85(109-10)50-32-73)62-94(90)102(95-63-80(40-58-91(95)101)100(74-33-51-86(110-11)52-34-74)75-35-53-87(111-12)54-36-75)92-60-77(97(68-19-15-64(3)16-20-68)69-23-41-81(105-6)42-24-69)37-55-88(92)89-56-38-78(61-93(89)102)98(70-25-43-82(106-7)44-26-70)71-27-45-83(107-8)46-28-71;1-7-66-37-39-68(43-66)45-76-59-23-9-47(10-24-59)65(48-11-25-60(26-12-48)77-46-69-40-38-67(8-2)44-69)63-41-53(70(49-13-27-55(72-3)28-14-49)50-15-29-56(73-4)30-16-50)21-35-61(63)62-36-22-54(42-64(62)65)71(51-17-31-57(74-5)32-18-51)52-19-33-58(75-6)34-20-52;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;1-11(7,8)6-12(9,10)2(3,4)5/h13-58,60-63,97-101H,1-2,59H2,3-12H3;7-44H,1-2,45-46H2,3-6H3;;;1H3/q+1;+2;3*-1.
What are the key properties of 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide?
1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide has a molecular weight of 3262.54 g/mol, XLogP of 37.89, 50 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(ethenyl)-4,5-dimethyl-2-[[4-[2',3,6-tris[bis(4-methoxyphenyl)methyl]-7'-[(4-methoxyphenyl)-(4-methylphenyl)methyl]spiro[9H-anthracene-10,9'-fluorene]-9-yl]phenyl]methyl]imidazol-1-ium;9,9-bis[4-[(3-ethenylimidazol-3-ium-1-yl)methoxy]phenyl]-2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)fluorene-2,7-diamine;bis(bis(trifluoromethylsulfonyl)azanide);methylsulfonyl(trifluoromethylsulfonyl)azanide is sourced from PubChem (CID 159520349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).