2-fluoranyl-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 2-fluoro-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid CAS Name: 2-fluoro-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-fluoro-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 2-fluoro-5-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Formula: C17H15F4NO5S MolecularWeight: 421.363313

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C17H15F4NO5S/c1-2-7-27-15-6-3-10(17(19,20)21)8-14(15)22-28(25,26)11-4-5-13(18)12(9-11)16(23)24/h3-6,8-9,22H,2,7H2,1H3,(H,23,24)