ethyl 4-(3-methylphenyl)-3-(phenylcarbonyl)-4,5-dihydro-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-(3-methylphenyl)-3-(phenylcarbonyl)-4,5-dihydro-1H-pyrazole-5-carboxylate Openeye Name: ethyl 3-benzoyl-4-(m-tolyl)-4,5-dihydro-1H-pyrazole-5-carboxylate CAS Name: 3-benzoyl-4-(3-methylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-4-(3-methylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxylate Traditional Name: 5-benzoyl-4-(m-tolyl)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=NN1)C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC(=O)C1C(C(=NN1)C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)C

InChI

InChI=1S/C20H20N2O3/c1-3-25-20(24)18-16(15-11-7-8-13(2)12-15)17(21-22-18)19(23)14-9-5-4-6-10-14/h4-12,16,18,22H,3H2,1-2H3