methyl 2-(3-chlorophenyl)-5-ethanoyl-3,4-dihydropyrazole-4-carboxylate

Systemtic Name: methyl 2-(3-chlorophenyl)-5-ethanoyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: methyl 5-acetyl-2-(3-chlorophenyl)-3,4-dihydropyrazole-4-carboxylate CAS Name: 5-acetyl-2-(3-chlorophenyl)-3,4-dihydropyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-2-(3-chlorophenyl)-3,4-dihydropyrazole-4-carboxylate Traditional Name: 3-acetyl-1-(3-chlorophenyl)-2-pyrazoline-4-carboxylic acid methyl ester Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(CC1C(=O)OC)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(=O)C1=NN(CC1C(=O)OC)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H13ClN2O3/c1-8(17)12-11(13(18)19-2)7-16(15-12)10-5-3-4-9(14)6-10/h3-6,11H,7H2,1-2H3