4-methyl-3-[[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzoic acid

Systemtic Name: 4-methyl-3-[[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzoic acid Openeye Name: 4-methyl-3-[[(Z)-[3-methyl-5-oxo-1-(p-tolyl)pyrazol-4-ylidene]methyl]amino]benzoic acid CAS Name: 4-methyl-3-[[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-4-pyrazolylidene]methyl]amino]benzoic acid IUPAC Name: 4-methyl-3-[[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxopyrazol-4-ylidene]methyl]amino]benzoic acid Traditional Name: 3-[[(Z)-[5-keto-3-methyl-1-(p-tolyl)-2-pyrazolin-4-ylidene]methyl]amino]-4-methyl-benzoic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CNC3=C(C=CC(=C3)C(=O)O)C)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C\NC3=C(C=CC(=C3)C(=O)O)C)/C(=N2)C

InChI

InChI=1S/C20H19N3O3/c1-12-4-8-16(9-5-12)23-19(24)17(14(3)22-23)11-21-18-10-15(20(25)26)7-6-13(18)2/h4-11,21H,1-3H3,(H,25,26)/b17-11-