2-[3-(trifluoromethyl)phenyl]sulfonylpropanoic acid

Systemtic Name: 2-[3-(trifluoromethyl)phenyl]sulfonylpropanoic acid Openeye Name: 2-[3-(trifluoromethyl)phenyl]sulfonylpropanoic acid CAS Name: 2-[3-(trifluoromethyl)phenyl]sulfonylpropanoic acid IUPAC Name: 2-[3-(trifluoromethyl)phenyl]sulfonylpropanoic acid Traditional Name: 2-[3-(trifluoromethyl)phenyl]sulfonylpropionic acid Formula: C10H9F3O4S MolecularWeight: 282.23627

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9F3O4S/c1-6(9(14)15)18(16,17)8-4-2-3-7(5-8)10(11,12)13/h2-6H,1H3,(H,14,15)