(phenylmethyl) 2-[(2,5-dimethylphenyl)carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[(2,5-dimethylphenyl)carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[(2,5-dimethylphenyl)carbamoyl]-5-oxo-pyrrolidine-1-carboxylate CAS Name: 2-[(2,5-dimethylanilino)-oxomethyl]-5-oxo-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2,5-dimethylphenyl)carbamoyl]-5-oxopyrrolidine-1-carboxylate Traditional Name: 2-[(2,5-dimethylphenyl)carbamoyl]-5-keto-pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2CCC(=O)N2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2CCC(=O)N2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-14-8-9-15(2)17(12-14)22-20(25)18-10-11-19(24)23(18)21(26)27-13-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13H2,1-2H3,(H,22,25)