2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate Openeye Name: 2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfonylacetate CAS Name: 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfonylacetate IUPAC Name: 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfonylacetate Traditional Name: 2-[2-(3,4-dimethoxyanilino)-2-keto-ethyl]sulfonylacetate Formula: C12H14NO7S- MolecularWeight: 316.30706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)CC(=O)[O-])OC

InChI

InChI=1S/C12H15NO7S/c1-19-9-4-3-8(5-10(9)20-2)13-11(14)6-21(17,18)7-12(15)16/h3-5H,6-7H2,1-2H3,(H,13,14)(H,15,16)/p-1