ethyl (2R,3S)-2-cyano-5-oxidanylidene-3-phenyl-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2R,3S)-2-cyano-5-oxidanylidene-3-phenyl-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2R,3S)-1-benzyl-2-cyano-5-oxo-3-phenyl-pyrrolidine-2-carboxylate CAS Name: (2R,3S)-2-cyano-5-oxo-3-phenyl-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S)-1-benzyl-2-cyano-5-oxo-3-phenylpyrrolidine-2-carboxylate Traditional Name: (2R,3S)-1-benzyl-2-cyano-5-keto-3-phenyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)[C@@]1([C@@H](CC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H20N2O3/c1-2-26-20(25)21(15-22)18(17-11-7-4-8-12-17)13-19(24)23(21)14-16-9-5-3-6-10-16/h3-12,18H,2,13-14H2,1H3/t18-,21-/m0/s1