2-[(4-methylphenyl)-methylsulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]ethanoic acid Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)acetic acid CAS Name: 2-(4-methyl-N-methylsulfonylanilino)acetic acid IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)acetic acid Traditional Name: 2-(N-mesyl-4-methyl-anilino)acetic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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