2-[(3-fluorophenyl)-methylsulfonyl-amino]propanoic acid

Systemtic Name: 2-[(3-fluorophenyl)-methylsulfonyl-amino]propanoic acid Openeye Name: 2-(3-fluoro-N-methylsulfonyl-anilino)propanoic acid CAS Name: 2-(3-fluoro-N-methylsulfonylanilino)propanoic acid IUPAC Name: 2-(3-fluoro-N-methylsulfonylanilino)propanoic acid Traditional Name: 2-(3-fluoro-N-mesyl-anilino)propionic acid Formula: C10H12FNO4S MolecularWeight: 261.269983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12FNO4S/c1-7(10(13)14)12(17(2,15)16)9-5-3-4-8(11)6-9/h3-7H,1-2H3,(H,13,14)