(phenylmethyl) (2S)-2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-(p-tolylcarbamoyl)pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(4-methylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-(p-tolylcarbamoyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@@H]2CCCN2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3/c1-15-9-11-17(12-10-15)21-19(23)18-8-5-13-22(18)20(24)25-14-16-6-3-2-4-7-16/h2-4,6-7,9-12,18H,5,8,13-14H2,1H3,(H,21,23)/t18-/m0/s1