[1-oxidanylidene-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 1-benzofuran-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 1-benzofuran-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [2-keto-1-methyl-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C20H20N2O6S MolecularWeight: 416.4476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CC(C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)OC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C20H20N2O6S/c1-13(27-20(24)18-12-15-4-2-3-5-17(15)28-18)19(23)22-11-10-14-6-8-16(9-7-14)29(21,25)26/h2-9,12-13H,10-11H2,1H3,(H,22,23)(H2,21,25,26)