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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC/C=C\C(C(=O)OC)SC1=CC=CC=C1

InChI

InChI=1S/C16H22O2S/c1-3-4-5-6-10-13-15(16(17)18-2)19-14-11-8-7-9-12-14/h7-13,15H,3-6H2,1-2H3/b13-10-