BHT

N-[4-(BIS{4-[(3-SULFOPHENYL)AMINO]PHENYL}METHYLENE)CYCLOHEXA-2,5-DIEN-1-YLIDENE]-4-SULFOBENZENAMINIUM


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Chemical Component Summary

NameN-[4-(BIS{4-[(3-SULFOPHENYL)AMINO]PHENYL}METHYLENE)CYCLOHEXA-2,5-DIEN-1-YLIDENE]-4-SULFOBENZENAMINIUM
SynonymsBLUE HT
Identifiers[4-[bis[4-[(3-sulfophenyl)amino]phenyl]methylidene]-1-cyclohexa-2,5-dienylidene]-(4-sulfophenyl)azanium
FormulaC37 H30 N3 O9 S3
Molecular Weight756.844
TypeNON-POLYMER
Isomeric SMILESc1cc(cc(c1)S(=O)(=O)O)Nc2ccc(cc2)C(=C3C=CC(=[NH+]c4ccc(cc4)S(=O)(=O)O)C=C3)c5ccc(cc5)Nc6cccc(c6)S(=O)(=O)O
InChIInChI=1S/C37H29N3O9S3/c41-50(42,43)34-21-19-31(20-22-34)38-28-13-7-25(8-14-28)37(26-9-15-29(16-10-26)39-32-3-1-5-35(23-32)51(44,45)46)27-11-17-30(18-12-27)40-33-4-2-6-36(24-33)52(47,48)49/h1-24,39-40H,(H,41,42,43)(H,44,45,46)(H,47,48,49)/p+1
InChIKeyQEJOESQJOWWNSS-UHFFFAOYSA-O

Chemical Details

Formal Charge1
Atom Count82
Chiral Atom Count0
Bond Count87
Aromatic Bond Count30