(3Z)-3-[[4-[(2Z)-2-[8-azanyl-7-[[4-[(2E)-2-(3-carboxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]-1-oxidanylidene-3,6-disulfo-naphthalen-2-ylidene]hydrazinyl]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: (3Z)-3-[[4-[(2Z)-2-[8-azanyl-7-[[4-[(2E)-2-(3-carboxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]-1-oxidanylidene-3,6-disulfo-naphthalen-2-ylidene]hydrazinyl]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: (3Z)-3-[[4-[(2Z)-2-[8-amino-7-[4-[(2E)-2-(3-carboxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]phenyl]azo-1-oxo-3,6-disulfo-2-naphthylidene]hydrazino]phenyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: (3Z)-3-[[4-[(2Z)-2-[8-amino-7-[4-[(2E)-2-(3-carboxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]phenyl]azo-1-oxo-3,6-disulfo-2-naphthalenylidene]hydrazinyl]phenyl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: (3Z)-3-[[4-[(2Z)-2-[8-amino-7-[[4-[(2E)-2-(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]-1-oxo-3,6-disulfonaphthalen-2-ylidene]hydrazinyl]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: (3Z)-3-[[4-[(N'Z)-N'-[8-amino-7-[4-[(N'E)-N'-(3-carboxy-4-keto-cyclohexa-2,5-dien-1-ylidene)hydrazino]phenyl]azo-1-keto-3,6-disulfo-2-naphthylidene]hydrazino]phenyl]hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylic acid Formula: C36H25N9O13S2 MolecularWeight: 855.7662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C=CC(=O)C(=C2)C(=O)O)NN=C3C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)NN=C6C=CC(=O)C(=C6)C(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N/N=C\2/C=CC(=O)C(=C2)C(=O)O)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)N/N=C/6\C=CC(=O)C(=C6)C(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C36H25N9O13S2/c37-31-30-17(13-28(59(53,54)55)32(31)44-40-20-5-1-18(2-6-20)38-42-22-9-11-26(46)24(15-22)35(49)50)14-29(60(56,57)58)33(34(30)48)45-41-21-7-3-19(4-8-21)39-43-23-10-12-27(47)25(16-23)36(51)52/h1-16,38-39,41H,37H2,(H,49,50)(H,51,52)(H,53,54,55)(H,56,57,58)/b42-22+,43-23-,44-40?,45-33+