(2R)-1-(3-methylsulfonylphenyl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-(3-methylsulfonylphenyl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-(3-methylsulfonylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[(3-methylsulfonylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-(3-methylsulfonylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-(3-mesylbenzoyl)proline Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCC[C@@H]2C(=O)O

InChI

InChI=1S/C13H15NO5S/c1-20(18,19)10-5-2-4-9(8-10)12(15)14-7-3-6-11(14)13(16)17/h2,4-5,8,11H,3,6-7H2,1H3,(H,16,17)/t11-/m1/s1