methyl (2S)-1-(2-cyano-2-phenyl-ethanoyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-(2-cyano-2-phenyl-ethanoyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-(2-cyano-2-phenyl-acetyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-cyano-1-oxo-2-phenylethyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(2-cyano-2-phenylacetyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-cyano-2-phenyl-acetyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C(C#N)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CCCN1C(=O)C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3/c1-20-15(19)13-8-5-9-17(13)14(18)12(10-16)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-9H2,1H3/t12?,13-/m0/s1