3-methyl-5-(methylsulfonylamino)benzoic acid

Systemtic Name: 3-methyl-5-(methylsulfonylamino)benzoic acid Openeye Name: 3-(methanesulfonamido)-5-methyl-benzoic acid CAS Name: 3-(methanesulfonamido)-5-methylbenzoic acid IUPAC Name: 3-(methanesulfonamido)-5-methylbenzoic acid Traditional Name: 3-(methanesulfonamido)-5-methyl-benzoic acid Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C9H11NO4S/c1-6-3-7(9(11)12)5-8(4-6)10-15(2,13)14/h3-5,10H,1-2H3,(H,11,12)