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

Systemtic Name: (3Z)-5-azanyl-6-[(5-azanyl-2-sulfo-phenyl)diazenyl]-7-methyl-3-[(5-methyl-1-sulfo-naphthalen-2-yl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3Z)-5-amino-6-(5-amino-2-sulfo-phenyl)azo-7-methyl-3-[(5-methyl-1-sulfo-2-naphthyl)hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-5-amino-6-(5-amino-2-sulfophenyl)azo-7-methyl-3-[(5-methyl-1-sulfo-2-naphthalenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-5-amino-6-[(5-amino-2-sulfophenyl)diazenyl]-7-methyl-3-[(5-methyl-1-sulfonaphthalen-2-yl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-5-amino-6-(5-amino-2-sulfo-phenyl)azo-4-keto-7-methyl-3-[(5-methyl-1-sulfo-2-naphthyl)hydrazono]naphthalene-2-sulfonic acid Formula: C28H24N6O10S3 MolecularWeight: 700.71936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=CC(=C2S(=O)(=O)O)NN=C3C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC=CC2=C1C=CC(=C2S(=O)(=O)O)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)N)S(=O)(=O)O)C)S(=O)(=O)O

InChI

InChI=1S/C28H24N6O10S3/c1-13-4-3-5-18-17(13)7-8-19(28(18)47(42,43)44)31-34-26-22(46(39,40)41)11-15-10-14(2)25(24(30)23(15)27(26)35)33-32-20-12-16(29)6-9-21(20)45(36,37)38/h3-12,31H,29-30H2,1-2H3,(H,36,37,38)(H,39,40,41)(H,42,43,44)/b33-32?,34-26+