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

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(phenylsulfonylamino)propanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O7S/c1-26-16-9-8-14(12-17(16)27-2)21-18(22)13-28-19(23)10-11-20-29(24,25)15-6-4-3-5-7-15/h3-9,12,20H,10-11,13H2,1-2H3,(H,21,22)