(2S,4S)-4-acetyloxy-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-acetyloxy-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-acetoxy-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-acetyloxy-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-acetyloxy-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-acetoxy-1-(4-fluorophenyl)sulfonyl-proline Formula: C13H14FNO6S MolecularWeight: 331.316763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

CC(=O)O[C@H]1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C13H14FNO6S/c1-8(16)21-10-6-12(13(17)18)15(7-10)22(19,20)11-4-2-9(14)3-5-11/h2-5,10,12H,6-7H2,1H3,(H,17,18)/t10-,12-/m0/s1