3-[(3-methoxyphenyl)-methylsulfonyl-amino]propanoic acid

Systemtic Name: 3-[(3-methoxyphenyl)-methylsulfonyl-amino]propanoic acid Openeye Name: 3-(3-methoxy-N-methylsulfonyl-anilino)propanoic acid CAS Name: 3-(3-methoxy-N-methylsulfonylanilino)propanoic acid IUPAC Name: 3-(3-methoxy-N-methylsulfonylanilino)propanoic acid Traditional Name: 3-(N-mesyl-3-methoxy-anilino)propionic acid Formula: C11H15NO5S MolecularWeight: 273.3055

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CCC(=O)O)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)N(CCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C11H15NO5S/c1-17-10-5-3-4-9(8-10)12(18(2,15)16)7-6-11(13)14/h3-5,8H,6-7H2,1-2H3,(H,13,14)