1-[2-(trifluoromethylsulfonyl)phenyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(trifluoromethylsulfonyl)phenyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(trifluoromethylsulfonyl)phenyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(trifluoromethylsulfonyl)phenyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(trifluoromethylsulfonyl)phenyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(2-triflylphenyl)proline Formula: C12H12F3NO4S MolecularWeight: 323.28819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3NO4S/c13-12(14,15)21(19,20)10-6-2-1-4-8(10)16-7-3-5-9(16)11(17)18/h1-2,4,6,9H,3,5,7H2,(H,17,18)