3-methyl-2-(methylsulfonylamino)-4-nitro-benzoic acid

Systemtic Name: 3-methyl-2-(methylsulfonylamino)-4-nitro-benzoic acid Openeye Name: 2-(methanesulfonamido)-3-methyl-4-nitro-benzoic acid CAS Name: 2-(methanesulfonamido)-3-methyl-4-nitrobenzoic acid IUPAC Name: 2-(methanesulfonamido)-3-methyl-4-nitrobenzoic acid Traditional Name: 2-(methanesulfonamido)-3-methyl-4-nitro-benzoic acid Formula: C9H10N2O6S MolecularWeight: 274.2505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1NS(=O)(=O)C)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1NS(=O)(=O)C)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O6S/c1-5-7(11(14)15)4-3-6(9(12)13)8(5)10-18(2,16)17/h3-4,10H,1-2H3,(H,12,13)