sodium (3E)-6-[(4-aminophenyl)diazenyl]-3-[(4-aminophenyl)hydrazinylidene]-5-azanyl-4-oxidanylidene-7-sulfo-naphthalene-2-sulfonate

Systemtic Name: sodium (3E)-6-[(4-aminophenyl)diazenyl]-3-[(4-aminophenyl)hydrazinylidene]-5-azanyl-4-oxidanylidene-7-sulfo-naphthalene-2-sulfonate Openeye Name: sodium (3E)-5-amino-6-(4-aminophenyl)azo-3-[(4-aminophenyl)hydrazono]-4-oxo-7-sulfo-naphthalene-2-sulfonate CAS Name: sodium (3E)-5-amino-6-(4-aminophenyl)azo-3-[(4-aminophenyl)hydrazinylidene]-4-oxo-7-sulfo-2-naphthalenesulfonate IUPAC Name: sodium (3E)-5-amino-6-[(4-aminophenyl)diazenyl]-3-[(4-aminophenyl)hydrazinylidene]-4-oxo-7-sulfonaphthalene-2-sulfonate Traditional Name: sodium (3E)-5-amino-6-(4-aminophenyl)azo-3-[(4-aminophenyl)hydrazono]-4-keto-7-sulfo-naphthalene-2-sulfonate Formula: C22H18N7NaO7S2 MolecularWeight: 579.54079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N)N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C22H19N7O7S2.Na/c23-12-1-5-14(6-2-12)26-28-20-16(37(31,32)33)9-11-10-17(38(34,35)36)21(22(30)18(11)19(20)25)29-27-15-7-3-13(24)4-8-15;/h1-10,27H,23-25H2,(H,31,32,33)(H,34,35,36);/q;+1/p-1/b28-26?,29-21-;