O1-methyl O4-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-oxo-2-(3-sulfamoylanilino)ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-oxo-2-(3-sulfamoylanilino)ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-(3-sulfamoylanilino)ethyl] ester O1-methyl ester Formula: C17H16N2O7S MolecularWeight: 392.38314

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C17H16N2O7S/c1-25-16(21)11-5-7-12(8-6-11)17(22)26-10-15(20)19-13-3-2-4-14(9-13)27(18,23)24/h2-9H,10H2,1H3,(H,19,20)(H2,18,23,24)