[(E)-3-fluoranyl-3-phenethylsulfanyl-prop-2-enyl] ethanoate

Systemtic Name: [(E)-3-fluoranyl-3-phenethylsulfanyl-prop-2-enyl] ethanoate Openeye Name: [(E)-3-fluoro-3-phenethylsulfanyl-allyl] acetate CAS Name: acetic acid [(E)-3-fluoro-3-(phenethylthio)prop-2-enyl] ester IUPAC Name: [(E)-3-fluoro-3-phenethylsulfanylprop-2-enyl] acetate Traditional Name: acetic acid [(E)-3-fluoro-3-(phenethylthio)allyl] ester Formula: C13H15FO2S MolecularWeight: 254.320403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC=C(F)SCCC1=CC=CC=C1

Isomeric SMILES

CC(=O)OC/C=C(\F)/SCCC1=CC=CC=C1

InChI

InChI=1S/C13H15FO2S/c1-11(15)16-9-7-13(14)17-10-8-12-5-3-2-4-6-12/h2-7H,8-10H2,1H3/b13-7+