(3Z)-5-azanyl-6-[(5-azanyl-2-sulfo-phenyl)diazenyl]-4-oxidanylidene-3-[(5-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (3Z)-5-azanyl-6-[(5-azanyl-2-sulfo-phenyl)diazenyl]-4-oxidanylidene-3-[(5-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (3Z)-5-amino-6-(5-amino-2-sulfo-phenyl)azo-4-oxo-3-[(5-sulfo-2-naphthyl)hydrazono]naphthalene-2-sulfonic acid CAS Name: (3Z)-5-amino-6-(5-amino-2-sulfophenyl)azo-4-oxo-3-[(5-sulfo-2-naphthalenyl)hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: (3Z)-5-amino-6-[(5-amino-2-sulfophenyl)diazenyl]-4-oxo-3-[(5-sulfonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: (3Z)-5-amino-6-(5-amino-2-sulfo-phenyl)azo-4-keto-3-[(5-sulfo-2-naphthyl)hydrazono]naphthalene-2-sulfonic acid Formula: C26H20N6O10S3 MolecularWeight: 672.6662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NN=C3C(=CC4=C(C3=O)C(=C(C=C4)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)N)S(=O)(=O)O)C(=C1)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)N/N=C/3\C(=CC4=C(C3=O)C(=C(C=C4)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)N)S(=O)(=O)O)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C26H20N6O10S3/c27-15-5-9-21(44(37,38)39)19(12-15)31-30-18-8-4-14-11-22(45(40,41)42)25(26(33)23(14)24(18)28)32-29-16-6-7-17-13(10-16)2-1-3-20(17)43(34,35)36/h1-12,29H,27-28H2,(H,34,35,36)(H,37,38,39)(H,40,41,42)/b31-30?,32-25+