4-[(Z)-[3-methyl-1-(2-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]benzoic acid

Systemtic Name: 4-[(Z)-[3-methyl-1-(2-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[3-methyl-1-(o-tolyl)-5-oxo-pyrazol-4-ylidene]methyl]benzoic acid CAS Name: 4-[(Z)-[3-methyl-1-(2-methylphenyl)-5-oxo-4-pyrazolylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[3-methyl-1-(2-methylphenyl)-5-oxopyrazol-4-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[5-keto-3-methyl-1-(o-tolyl)-2-pyrazolin-4-ylidene]methyl]benzoic acid Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(C=C3)C(=O)O)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=C\C3=CC=C(C=C3)C(=O)O)/C(=N2)C

InChI

InChI=1S/C19H16N2O3/c1-12-5-3-4-6-17(12)21-18(22)16(13(2)20-21)11-14-7-9-15(10-8-14)19(23)24/h3-11H,1-2H3,(H,23,24)/b16-11-