5-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfonyl-2-methoxy-benzoic acid

Systemtic Name: 5-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfonyl-2-methoxy-benzoic acid Openeye Name: 5-[2-(dimethylamino)-2-oxo-ethyl]sulfonyl-2-methoxy-benzoic acid CAS Name: 5-[2-(dimethylamino)-2-oxoethyl]sulfonyl-2-methoxybenzoic acid IUPAC Name: 5-[2-(dimethylamino)-2-oxoethyl]sulfonyl-2-methoxybenzoic acid Traditional Name: 5-[2-(dimethylamino)-2-keto-ethyl]sulfonyl-2-methoxy-benzoic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

Isomeric SMILES

CN(C)C(=O)CS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C12H15NO6S/c1-13(2)11(14)7-20(17,18)8-4-5-10(19-3)9(6-8)12(15)16/h4-6H,7H2,1-3H3,(H,15,16)