3-(dimethylamino)-5-methylsulfonyl-benzoic acid

Systemtic Name: 3-(dimethylamino)-5-methylsulfonyl-benzoic acid Openeye Name: 3-(dimethylamino)-5-methylsulfonyl-benzoic acid CAS Name: 3-(dimethylamino)-5-methylsulfonylbenzoic acid IUPAC Name: 3-(dimethylamino)-5-methylsulfonylbenzoic acid Traditional Name: 3-(dimethylamino)-5-mesyl-benzoic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC(=C1)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC(=CC(=C1)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C10H13NO4S/c1-11(2)8-4-7(10(12)13)5-9(6-8)16(3,14)15/h4-6H,1-3H3,(H,12,13)