3-[[4-fluoranyl-3-(5-oxidanyl-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[4-fluoranyl-3-(5-oxidanyl-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[4-fluoro-3-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[4-fluoro-3-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[4-fluoro-3-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-fluoro-3-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]sulfamoyl]benzoic acid Formula: C20H14FNO7S MolecularWeight: 431.391063

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C=C2)O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O)F

Isomeric SMILES

C1OC2=C(O1)C(=C(C=C2)O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O)F

InChI

InChI=1S/C20H14FNO7S/c21-15-5-4-12(22-30(26,27)13-3-1-2-11(8-13)20(24)25)9-14(15)18-16(23)6-7-17-19(18)29-10-28-17/h1-9,22-23H,10H2,(H,24,25)