sodium (3E)-7-[(4-aminophenyl)carbonylamino]-3-[(2-methoxy-5-methyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (3E)-7-[(4-aminophenyl)carbonylamino]-3-[(2-methoxy-5-methyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (3E)-7-[(4-aminobenzoyl)amino]-3-[(2-methoxy-5-methyl-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: sodium (3E)-7-[[(4-aminophenyl)-oxomethyl]amino]-3-[(2-methoxy-5-methylphenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium (3E)-7-[(4-aminobenzoyl)amino]-3-[(2-methoxy-5-methylphenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: sodium (3E)-7-[(4-aminobenzoyl)amino]-4-keto-3-[(2-methoxy-5-methyl-phenyl)hydrazono]naphthalene-2-sulfonate Formula: C25H21N4NaO6S MolecularWeight: 528.51221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C25H22N4O6S.Na/c1-14-3-10-21(35-2)20(11-14)28-29-23-22(36(32,33)34)13-16-12-18(8-9-19(16)24(23)30)27-25(31)15-4-6-17(26)7-5-15;/h3-13,28H,26H2,1-2H3,(H,27,31)(H,32,33,34);/q;+1/p-1/b29-23-;