ethyl 4-(4-methylphenyl)-3-(phenylcarbonyl)-2,3-dihydro-1H-pyrazole-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(NN1)C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(NN1)C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

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