ethyl (Z)-2-(phenylmethylsulfanyl)non-2-enoate

Systemtic Name: ethyl (Z)-2-(phenylmethylsulfanyl)non-2-enoate Openeye Name: ethyl (Z)-2-benzylsulfanylnon-2-enoate CAS Name: (Z)-2-(phenylmethylthio)-2-nonenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-benzylsulfanylnon-2-enoate Traditional Name: (Z)-2-(benzylthio)non-2-enoic acid ethyl ester Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=C(C(=O)OCC)SCC1=CC=CC=C1

Isomeric SMILES

CCCCCC/C=C(/C(=O)OCC)\SCC1=CC=CC=C1

InChI

InChI=1S/C18H26O2S/c1-3-5-6-7-11-14-17(18(19)20-4-2)21-15-16-12-9-8-10-13-16/h8-10,12-14H,3-7,11,15H2,1-2H3/b17-14-