2-[[4-fluoranyl-2-(trifluoromethyl)phenyl]sulfamoyl]benzenesulfonic acid

Systemtic Name: 2-[[4-fluoranyl-2-(trifluoromethyl)phenyl]sulfamoyl]benzenesulfonic acid Openeye Name: 2-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfamoyl]benzenesulfonic acid CAS Name: 2-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfamoyl]benzenesulfonic acid IUPAC Name: 2-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfamoyl]benzenesulfonic acid Traditional Name: 2-[[4-fluoro-2-(trifluoromethyl)phenyl]sulfamoyl]besylic acid Formula: C13H9F4NO5S2 MolecularWeight: 399.337873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)S(=O)(=O)NC2=C(C=C(C=C2)F)C(F)(F)F)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)S(=O)(=O)NC2=C(C=C(C=C2)F)C(F)(F)F)S(=O)(=O)O

InChI

InChI=1S/C13H9F4NO5S2/c14-8-5-6-10(9(7-8)13(15,16)17)18-24(19,20)11-3-1-2-4-12(11)25(21,22)23/h1-7,18H,(H,21,22,23)