methyl 3,3,3-tris(fluoranyl)-2-phenylsulfanyl-2-(trifluoromethyl)propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-phenylsulfanyl-2-(trifluoromethyl)propanoate Openeye Name: methyl 3,3,3-trifluoro-2-phenylsulfanyl-2-(trifluoromethyl)propanoate CAS Name: 3,3,3-trifluoro-2-(phenylthio)-2-(trifluoromethyl)propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-phenylsulfanyl-2-(trifluoromethyl)propanoate Traditional Name: 3,3,3-trifluoro-2-(phenylthio)-2-(trifluoromethyl)propionic acid methyl ester Formula: C11H8F6O2S MolecularWeight: 318.235439

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(F)(F)F)(C(F)(F)F)SC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(C(F)(F)F)(C(F)(F)F)SC1=CC=CC=C1

InChI

InChI=1S/C11H8F6O2S/c1-19-8(18)9(10(12,13)14,11(15,16)17)20-7-5-3-2-4-6-7/h2-6H,1H3