(2S)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-2-[(2-cyanophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-2-(2-cyanobenzyl)proline Formula: C13H14N2O2 MolecularWeight: 230.26246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)(CC2=CC=CC=C2C#N)C(=O)O

Isomeric SMILES

C1C[C@](NC1)(CC2=CC=CC=C2C#N)C(=O)O

InChI

InChI=1S/C13H14N2O2/c14-9-11-5-2-1-4-10(11)8-13(12(16)17)6-3-7-15-13/h1-2,4-5,15H,3,6-8H2,(H,16,17)/t13-/m0/s1