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

Systemtic Name: 3-[4-[[4-bromanyl-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[4-bromo-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[4-bromo-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-bromo-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[4-bromo-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propionic acid Formula: C16H13BrF3NO4S MolecularWeight: 452.24293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C16H13BrF3NO4S/c17-14-7-4-11(9-13(14)16(18,19)20)21-26(24,25)12-5-1-10(2-6-12)3-8-15(22)23/h1-2,4-7,9,21H,3,8H2,(H,22,23)