methyl (2S,4S,5R)-4-cyano-5-phenyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S,5R)-4-cyano-5-phenyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S,5R)-4-cyano-5-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S,4S,5R)-4-cyano-5-phenyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S,5R)-4-cyano-5-phenylpyrrolidine-2-carboxylate Traditional Name: (2S,4S,5R)-4-cyano-5-phenyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C(N1)C2=CC=CC=C2)C#N

Isomeric SMILES

COC(=O)[C@@H]1C[C@@H]([C@@H](N1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C13H14N2O2/c1-17-13(16)11-7-10(8-14)12(15-11)9-5-3-2-4-6-9/h2-6,10-12,15H,7H2,1H3/t10-,11+,12+/m1/s1