2-fluoranyl-5-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-5-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 2-fluoro-5-[[3-(2-furylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid CAS Name: 2-fluoro-5-[[3-(2-furanylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-fluoro-5-[[3-(furan-2-ylmethylsulfamoyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 2-fluoro-5-[[3-(2-furfurylsulfamoyl)phenyl]sulfamoyl]benzoic acid Formula: C18H15FN2O7S2 MolecularWeight: 454.449303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15FN2O7S2/c19-17-7-6-15(10-16(17)18(22)23)30(26,27)21-12-3-1-5-14(9-12)29(24,25)20-11-13-4-2-8-28-13/h1-10,20-21H,11H2,(H,22,23)