methyl 2-(4-methylphenyl)-3-[(phenylmethyl)carbamoyl]-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl 2-(4-methylphenyl)-3-[(phenylmethyl)carbamoyl]-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl 3-(benzylcarbamoyl)-2-(p-tolyl)-3,4-dihydropyrazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3-[oxo-[(phenylmethyl)amino]methyl]-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(benzylcarbamoyl)-2-(4-methylphenyl)-3,4-dihydropyrazole-5-carboxylate Traditional Name: 5-(benzylcarbamoyl)-1-(p-tolyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(CC(=N2)C(=O)OC)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(CC(=N2)C(=O)OC)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3/c1-14-8-10-16(11-9-14)23-18(12-17(22-23)20(25)26-2)19(24)21-13-15-6-4-3-5-7-15/h3-11,18H,12-13H2,1-2H3,(H,21,24)