4-methyl-3-(methylsulfonylamino)benzoate

Systemtic Name: 4-methyl-3-(methylsulfonylamino)benzoate Openeye Name: 3-(methanesulfonamido)-4-methyl-benzoate CAS Name: 3-(methanesulfonamido)-4-methylbenzoate IUPAC Name: 3-(methanesulfonamido)-4-methylbenzoate Traditional Name: 3-(methanesulfonamido)-4-methyl-benzoate Formula: C9H10NO4S- MolecularWeight: 228.245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)C

InChI

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