4-(4-acetamidophenoxy)-5-(ethanoylsulfamoyl)-2-(furan-3-ylmethylamino)benzoic acid

Systemtic Name: 4-(4-acetamidophenoxy)-5-(ethanoylsulfamoyl)-2-(furan-3-ylmethylamino)benzoic acid Openeye Name: 4-(4-acetamidophenoxy)-5-(acetylsulfamoyl)-2-(3-furylmethylamino)benzoic acid CAS Name: 4-(4-acetamidophenoxy)-5-(acetylsulfamoyl)-2-(3-furanylmethylamino)benzoic acid IUPAC Name: 4-(4-acetamidophenoxy)-5-(acetylsulfamoyl)-2-(furan-3-ylmethylamino)benzoic acid Traditional Name: 4-(4-acetamidophenoxy)-5-(acetylsulfamoyl)-2-(3-furfurylamino)benzoic acid Formula: C22H21N3O8S MolecularWeight: 487.48244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C(=C2)NCC3=COC=C3)C(=O)O)S(=O)(=O)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C(=C2)NCC3=COC=C3)C(=O)O)S(=O)(=O)NC(=O)C

InChI

InChI=1S/C22H21N3O8S/c1-13(26)24-16-3-5-17(6-4-16)33-20-10-19(23-11-15-7-8-32-12-15)18(22(28)29)9-21(20)34(30,31)25-14(2)27/h3-10,12,23H,11H2,1-2H3,(H,24,26)(H,25,27)(H,28,29)