ethyl 4-(4-chlorophenyl)carbonyl-1-(3-methylphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)carbonyl-1-(3-methylphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-(4-chlorobenzoyl)-1-(m-tolyl)pyrazole-3-carboxylate CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-(3-methylphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorobenzoyl)-1-(3-methylphenyl)pyrazole-3-carboxylate Traditional Name: 4-(4-chlorobenzoyl)-1-(m-tolyl)pyrazole-3-carboxylic acid ethyl ester Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1C(=O)C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C=C1C(=O)C2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C

InChI

InChI=1S/C20H17ClN2O3/c1-3-26-20(25)18-17(19(24)14-7-9-15(21)10-8-14)12-23(22-18)16-6-4-5-13(2)11-16/h4-12H,3H2,1-2H3