methyl (Z)-3-phenylsulfanylnon-2-enoate

Systemtic Name: methyl (Z)-3-phenylsulfanylnon-2-enoate Openeye Name: methyl (Z)-3-phenylsulfanylnon-2-enoate CAS Name: (Z)-3-(phenylthio)-2-nonenoic acid methyl ester IUPAC Name: methyl (Z)-3-phenylsulfanylnon-2-enoate Traditional Name: (Z)-3-(phenylthio)non-2-enoic acid methyl ester Formula: C16H22O2S MolecularWeight: 278.40968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CC(=O)OC)SC1=CC=CC=C1

Isomeric SMILES

CCCCCC/C(=C/C(=O)OC)/SC1=CC=CC=C1

InChI

InChI=1S/C16H22O2S/c1-3-4-5-7-12-15(13-16(17)18-2)19-14-10-8-6-9-11-14/h6,8-11,13H,3-5,7,12H2,1-2H3/b15-13-