(2S)-1-(2-sulfanylphenyl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(2-sulfanylphenyl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(2-sulfanylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2-mercaptophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(2-sulfanylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(2-mercaptobenzoyl)proline Formula: C12H13NO3S MolecularWeight: 251.30152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CC=C2S)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CC=C2S)C(=O)O

InChI

InChI=1S/C12H13NO3S/c14-11(8-4-1-2-6-10(8)17)13-7-3-5-9(13)12(15)16/h1-2,4,6,9,17H,3,5,7H2,(H,15,16)/t9-/m0/s1