prop-2-enyl 4-oxidanylidene-3-phenylsulfanyl-pentanoate

Systemtic Name: prop-2-enyl 4-oxidanylidene-3-phenylsulfanyl-pentanoate Openeye Name: allyl 4-oxo-3-phenylsulfanyl-pentanoate CAS Name: 4-oxo-3-(phenylthio)pentanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-oxo-3-phenylsulfanylpentanoate Traditional Name: 4-keto-3-(phenylthio)valeric acid allyl ester Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(=O)OCC=C)SC1=CC=CC=C1

Isomeric SMILES

CC(=O)C(CC(=O)OCC=C)SC1=CC=CC=C1

InChI

InChI=1S/C14H16O3S/c1-3-9-17-14(16)10-13(11(2)15)18-12-7-5-4-6-8-12/h3-8,13H,1,9-10H2,2H3