methyl (E)-2-methylsulfanylnon-4-enoate

Systemtic Name: methyl (E)-2-methylsulfanylnon-4-enoate Openeye Name: methyl (E)-2-methylsulfanylnon-4-enoate CAS Name: (E)-2-(methylthio)-4-nonenoic acid methyl ester IUPAC Name: methyl (E)-2-methylsulfanylnon-4-enoate Traditional Name: (E)-2-(methylthio)non-4-enoic acid methyl ester Formula: C11H20O2S MolecularWeight: 216.3403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCC(C(=O)OC)SC

Isomeric SMILES

CCCC/C=C/CC(C(=O)OC)SC

InChI

InChI=1S/C11H20O2S/c1-4-5-6-7-8-9-10(14-3)11(12)13-2/h7-8,10H,4-6,9H2,1-3H3/b8-7+