4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzoic acid

Systemtic Name: 4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzoic acid Openeye Name: 4-(2,2,2-trifluoroethylsulfanyl)benzoic acid CAS Name: 4-(2,2,2-trifluoroethylthio)benzoic acid IUPAC Name: 4-(2,2,2-trifluoroethylsulfanyl)benzoic acid Traditional Name: 4-(2,2,2-trifluoroethylthio)benzoic acid Formula: C9H7F3O2S MolecularWeight: 236.21089

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SCC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SCC(F)(F)F

InChI

InChI=1S/C9H7F3O2S/c10-9(11,12)5-15-7-3-1-6(2-4-7)8(13)14/h1-4H,5H2,(H,13,14)