2,3-dimethoxy-5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid

Systemtic Name: 2,3-dimethoxy-5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid Openeye Name: 2,3-dimethoxy-5-[2-(methylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 2,3-dimethoxy-5-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 2,3-dimethoxy-5-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 5-[2-keto-2-(methylamino)ethyl]sulfonyl-2,3-dimethoxy-benzoic acid Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO7S/c1-13-10(14)6-21(17,18)7-4-8(12(15)16)11(20-3)9(5-7)19-2/h4-5H,6H2,1-3H3,(H,13,14)(H,15,16)