(3Z)-6-azanyl-3-[[4-[(5-azanyl-2-sulfo-phenyl)diazenyl]-7-sulfo-naphthalen-1-yl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3Z)-6-azanyl-3-[[4-[(5-azanyl-2-sulfo-phenyl)diazenyl]-7-sulfo-naphthalen-1-yl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3Z)-6-amino-3-[[4-(5-amino-2-sulfo-phenyl)azo-7-sulfo-1-naphthyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-6-amino-3-[[4-(5-amino-2-sulfophenyl)azo-7-sulfo-1-naphthalenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-6-amino-3-[[4-[(5-amino-2-sulfophenyl)diazenyl]-7-sulfonaphthalen-1-yl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-6-amino-3-[[4-(5-amino-2-sulfo-phenyl)azo-7-sulfo-1-naphthyl]hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C26H20N6O10S3 MolecularWeight: 672.6662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)C(=O)C(=NNC3=C4C=C(C=CC4=C(C=C3)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)S(=O)(=O)O)C(=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1N)C(=O)/C(=N/NC3=C4C=C(C=CC4=C(C=C3)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)S(=O)(=O)O)/C(=C2)S(=O)(=O)O

InChI

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