[2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 4-methoxy-3-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 4-methoxy-3-sulfamoyl-benzoate Openeye Name: [2-oxo-2-[[phenyl(2-thienyl)methyl]amino]ethyl] 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid [2-keto-2-[[phenyl(2-thienyl)methyl]amino]ethyl] ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)N

InChI

InChI=1S/C21H20N2O6S2/c1-28-16-10-9-15(12-18(16)31(22,26)27)21(25)29-13-19(24)23-20(17-8-5-11-30-17)14-6-3-2-4-7-14/h2-12,20H,13H2,1H3,(H,23,24)(H2,22,26,27)