4-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 4-[[3-(2-furylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-[[3-(2-furanylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 4-[[3-(2-furfurylsulfamoyl)phenyl]sulfamoyl]benzoic acid Formula: C18H16N2O7S2 MolecularWeight: 436.45884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCC2=CC=CO2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCC2=CC=CO2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H16N2O7S2/c21-18(22)13-6-8-16(9-7-13)29(25,26)20-14-3-1-5-17(11-14)28(23,24)19-12-15-4-2-10-27-15/h1-11,19-20H,12H2,(H,21,22)