methyl 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: methyl 2-(3,5-dimethyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(3,5-dimethyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)acetic acid methyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)OC)S(=O)(=O)C)C

InChI

InChI=1S/C12H17NO4S/c1-9-5-10(2)7-11(6-9)13(18(4,15)16)8-12(14)17-3/h5-7H,8H2,1-4H3