methyl 2-methyl-3-[(4-methylsulfonylphenyl)amino]propanoate

Systemtic Name: methyl 2-methyl-3-[(4-methylsulfonylphenyl)amino]propanoate Openeye Name: methyl 2-methyl-3-(4-methylsulfonylanilino)propanoate CAS Name: 2-methyl-3-(4-methylsulfonylanilino)propanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-methylsulfonylanilino)propanoate Traditional Name: 3-(4-mesylanilino)-2-methyl-propionic acid methyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=C(C=C1)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC(CNC1=CC=C(C=C1)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C12H17NO4S/c1-9(12(14)17-2)8-13-10-4-6-11(7-5-10)18(3,15)16/h4-7,9,13H,8H2,1-3H3