3-[[4-[[4-fluoranyl-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[4-fluoranyl-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[4-fluoro-3-(trifluoromethyl)phenyl]sulfamoyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[[4-fluoro-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[[4-fluoro-3-(trifluoromethyl)phenyl]sulfamoyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[[4-fluoro-3-(trifluoromethyl)phenyl]sulfamoyl]benzoyl]amino]propionic acid Formula: C17H14F4N2O5S MolecularWeight: 434.362073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)F)C(F)(F)F

InChI

InChI=1S/C17H14F4N2O5S/c18-14-6-3-11(9-13(14)17(19,20)21)23-29(27,28)12-4-1-10(2-5-12)16(26)22-8-7-15(24)25/h1-6,9,23H,7-8H2,(H,22,26)(H,24,25)