methyl 2,2-bis(fluoranyl)-2-phenylsulfanyl-ethanoate

Systemtic Name: methyl 2,2-bis(fluoranyl)-2-phenylsulfanyl-ethanoate Openeye Name: methyl 2,2-difluoro-2-phenylsulfanyl-acetate CAS Name: 2,2-difluoro-2-(phenylthio)acetic acid methyl ester IUPAC Name: methyl 2,2-difluoro-2-phenylsulfanylacetate Traditional Name: 2,2-difluoro-2-(phenylthio)acetic acid methyl ester Formula: C9H8F2O2S MolecularWeight: 218.220426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8F2O2S/c1-13-8(12)9(10,11)14-7-5-3-2-4-6-7/h2-6H,1H3