(6Z)-7-methyl-4-[(4-methylphenyl)carbonylamino]-5-oxidanylidene-6-[(2-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (6Z)-7-methyl-4-[(4-methylphenyl)carbonylamino]-5-oxidanylidene-6-[(2-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (6Z)-7-methyl-4-[(4-methylbenzoyl)amino]-5-oxo-6-[(2-sulfophenyl)hydrazono]naphthalene-2-sulfonic acid CAS Name: (6Z)-7-methyl-4-[[(4-methylphenyl)-oxomethyl]amino]-5-oxo-6-[(2-sulfophenyl)hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: (6Z)-7-methyl-4-[(4-methylbenzoyl)amino]-5-oxo-6-[(2-sulfophenyl)hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: (6Z)-5-keto-7-methyl-4-(p-toluoylamino)-6-[(2-sulfophenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C25H21N3O8S2 MolecularWeight: 555.57954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C(=NNC4=CC=CC=C4S(=O)(=O)O)C3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N/NC4=CC=CC=C4S(=O)(=O)O)/C3=O)C

InChI

InChI=1S/C25H21N3O8S2/c1-14-7-9-16(10-8-14)25(30)26-20-13-18(37(31,32)33)12-17-11-15(2)23(24(29)22(17)20)28-27-19-5-3-4-6-21(19)38(34,35)36/h3-13,27H,1-2H3,(H,26,30)(H,31,32,33)(H,34,35,36)/b28-23-