[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)-4-oxidanyl-pyrazole-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)-4-oxidanyl-pyrazole-3-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] 1-(4-chlorophenyl)-4-hydroxy-pyrazole-3-carboxylate CAS Name: 1-(4-chlorophenyl)-4-hydroxy-3-pyrazolecarboxylic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] 1-(4-chlorophenyl)-4-hydroxypyrazole-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-4-hydroxy-pyrazole-3-carboxylic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C19H16ClN3O4 MolecularWeight: 385.80104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=NN(C=C2O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC(=O)C2=NN(C=C2O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClN3O4/c1-12-2-6-14(7-3-12)21-17(25)11-27-19(26)18-16(24)10-23(22-18)15-8-4-13(20)5-9-15/h2-10,24H,11H2,1H3,(H,21,25)