3-[2-[3-(trifluoromethyl)phenyl]sulfanylethylsulfanyl]propanoic acid

Systemtic Name: 3-[2-[3-(trifluoromethyl)phenyl]sulfanylethylsulfanyl]propanoic acid Openeye Name: 3-[2-[3-(trifluoromethyl)phenyl]sulfanylethylsulfanyl]propanoic acid CAS Name: 3-[2-[[3-(trifluoromethyl)phenyl]thio]ethylthio]propanoic acid IUPAC Name: 3-[2-[3-(trifluoromethyl)phenyl]sulfanylethylsulfanyl]propanoic acid Traditional Name: 3-[2-[[3-(trifluoromethyl)phenyl]thio]ethylthio]propionic acid Formula: C12H13F3O2S2 MolecularWeight: 310.35563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3O2S2/c13-12(14,15)9-2-1-3-10(8-9)19-7-6-18-5-4-11(16)17/h1-3,8H,4-7H2,(H,16,17)