(phenylmethyl) (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxylate CAS Name: (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxylate Traditional Name: (2S,3S)-3-(cyanomethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCC(C2C(=O)OCC3=CC=CC=C3)CC#N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N2CC[C@H]([C@H]2C(=O)OCC3=CC=CC=C3)CC#N

InChI

InChI=1S/C22H24N2O2/c1-17(19-10-6-3-7-11-19)24-15-13-20(12-14-23)21(24)22(25)26-16-18-8-4-2-5-9-18/h2-11,17,20-21H,12-13,15-16H2,1H3/t17-,20+,21-/m0/s1