[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-(2,4-dimethoxyanilino)-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-(2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-(2,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C17H17FN2O7S MolecularWeight: 412.389483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)F)OC

InChI

InChI=1S/C17H17FN2O7S/c1-25-10-3-6-14(15(7-10)26-2)20-16(21)9-27-17(22)12-8-11(28(19,23)24)4-5-13(12)18/h3-8H,9H2,1-2H3,(H,20,21)(H2,19,23,24)