3-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-sulfamoyl]benzoic acid

Systemtic Name: 3-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-sulfamoyl]benzoic acid Openeye Name: 3-[[2-(2-furylmethylcarbamoyl)phenyl]-methyl-sulfamoyl]benzoic acid CAS Name: 3-[[2-[(2-furanylmethylamino)-oxomethyl]phenyl]-methylsulfamoyl]benzoic acid IUPAC Name: 3-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methylsulfamoyl]benzoic acid Traditional Name: 3-[[2-(2-furfurylcarbamoyl)phenyl]-methyl-sulfamoyl]benzoic acid Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H18N2O6S/c1-22(29(26,27)16-8-4-6-14(12-16)20(24)25)18-10-3-2-9-17(18)19(23)21-13-15-7-5-11-28-15/h2-12H,13H2,1H3,(H,21,23)(H,24,25)