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

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 2-(benzenesulfonamido)acetate CAS Name: 2-(benzenesulfonamido)acetic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-(benzenesulfonamido)acetate Traditional Name: 2-(benzenesulfonamido)acetic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C18H20N2O7S MolecularWeight: 408.4256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C18H20N2O7S/c1-25-15-9-8-13(10-16(15)26-2)20-17(21)12-27-18(22)11-19-28(23,24)14-6-4-3-5-7-14/h3-10,19H,11-12H2,1-2H3,(H,20,21)