[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] 5-ethoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-ethoxy-3-methyl-2-benzofurancarboxylic acid [(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-ethoxy-3-methyl-coumarilic acid [(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)O[C@H](C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H22N2O7S/c1-4-28-15-7-10-18-17(11-15)12(2)19(30-18)21(25)29-13(3)20(24)23-14-5-8-16(9-6-14)31(22,26)27/h5-11,13H,4H2,1-3H3,(H,23,24)(H2,22,26,27)/t13-/m1/s1