4-[(Z)-[3-[(2-methylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoic acid

Systemtic Name: 4-[(Z)-[3-[(2-methylphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoic acid Openeye Name: 4-[(Z)-[3-(2-methylanilino)-4-oxo-1-naphthylidene]amino]sulfonylbenzoic acid CAS Name: 4-[(Z)-[3-(2-methylanilino)-4-oxo-1-naphthalenylidene]amino]sulfonylbenzoic acid IUPAC Name: 4-[(Z)-[3-(2-methylanilino)-4-oxonaphthalen-1-ylidene]amino]sulfonylbenzoic acid Traditional Name: 4-[(Z)-[4-keto-3-(o-toluidino)-1-naphthylidene]amino]sulfonylbenzoic acid Formula: C24H18N2O5S MolecularWeight: 446.47512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=CC(=NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4C2=O

Isomeric SMILES

CC1=CC=CC=C1NC2=C/C(=N/S(=O)(=O)C3=CC=C(C=C3)C(=O)O)/C4=CC=CC=C4C2=O

InChI

InChI=1S/C24H18N2O5S/c1-15-6-2-5-9-20(15)25-22-14-21(18-7-3-4-8-19(18)23(22)27)26-32(30,31)17-12-10-16(11-13-17)24(28)29/h2-14,25H,1H3,(H,28,29)/b26-21-