2-[(3-methylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: 2-[(3-methylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: 2-(3-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(3-methyl-N-methylsulfonylanilino)acetate IUPAC Name: 2-(3-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-3-methyl-anilino)acetate Formula: C10H12NO4S- MolecularWeight: 242.27158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C10H13NO4S/c1-8-4-3-5-9(6-8)11(7-10(12)13)16(2,14)15/h3-6H,7H2,1-2H3,(H,12,13)/p-1