2-ethanoylsulfanyl-3-(trifluoromethyl)benzoic acid

Systemtic Name: 2-ethanoylsulfanyl-3-(trifluoromethyl)benzoic acid Openeye Name: 2-acetylsulfanyl-3-(trifluoromethyl)benzoic acid CAS Name: 2-(acetylthio)-3-(trifluoromethyl)benzoic acid IUPAC Name: 2-acetylsulfanyl-3-(trifluoromethyl)benzoic acid Traditional Name: 2-(acetylthio)-3-(trifluoromethyl)benzoic acid Formula: C10H7F3O3S MolecularWeight: 264.22099

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=C(C=CC=C1C(F)(F)F)C(=O)O

Isomeric SMILES

CC(=O)SC1=C(C=CC=C1C(F)(F)F)C(=O)O

InChI

InChI=1S/C10H7F3O3S/c1-5(14)17-8-6(9(15)16)3-2-4-7(8)10(11,12)13/h2-4H,1H3,(H,15,16)