[(1R)-1-cyanoethyl] (3S)-5-oxidanylidene-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] (3S)-5-oxidanylidene-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: [(1R)-1-cyanoethyl] (3S)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[(1S)-1-phenylethyl]-3-pyrrolidinecarboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (3S)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylic acid [(1R)-1-cyanoethyl] ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1CC(=O)N(C1)C(C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C#N)OC(=O)[C@H]1CC(=O)N(C1)[C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3/c1-11(9-17)21-16(20)14-8-15(19)18(10-14)12(2)13-6-4-3-5-7-13/h3-7,11-12,14H,8,10H2,1-2H3/t11-,12+,14+/m1/s1