methyl 2-acetamido-3-(4-methylphenyl)sulfonyloxy-propanoate

Systemtic Name: methyl 2-acetamido-3-(4-methylphenyl)sulfonyloxy-propanoate Openeye Name: methyl 2-acetamido-3-(p-tolylsulfonyloxy)propanoate CAS Name: 2-acetamido-3-(4-methylphenyl)sulfonyloxypropanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-(4-methylphenyl)sulfonyloxypropanoate Traditional Name: 2-acetamido-3-tosyloxy-propionic acid methyl ester Formula: C13H17NO6S MolecularWeight: 315.34218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(=O)OC)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(=O)OC)NC(=O)C

InChI

InChI=1S/C13H17NO6S/c1-9-4-6-11(7-5-9)21(17,18)20-8-12(13(16)19-3)14-10(2)15/h4-7,12H,8H2,1-3H3,(H,14,15)