methyl (E)-3-fluoranyl-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate

Systemtic Name: methyl (E)-3-fluoranyl-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate Openeye Name: methyl (E)-3-fluoro-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate CAS Name: (E)-3-fluoro-3-(phenacylthio)-2-(trifluoromethyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-fluoro-3-phenacylsulfanyl-2-(trifluoromethyl)prop-2-enoate Traditional Name: (E)-3-fluoro-3-(phenacylthio)-2-(trifluoromethyl)acrylic acid methyl ester Formula: C13H10F4O3S MolecularWeight: 322.275313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C(=C(/F)\SCC(=O)C1=CC=CC=C1)/C(F)(F)F

InChI

InChI=1S/C13H10F4O3S/c1-20-12(19)10(13(15,16)17)11(14)21-7-9(18)8-5-3-2-4-6-8/h2-6H,7H2,1H3/b11-10+