methyl 3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]sulfanylpropanoate

Systemtic Name: methyl 3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]sulfanylpropanoate Openeye Name: methyl 3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]sulfanylpropanoate CAS Name: 3-[[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]sulfanylpropanoate Traditional Name: 3-[[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]thio]propionic acid methyl ester Formula: C18H30O2S MolecularWeight: 310.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCC=CCSCCC(=O)OC

Isomeric SMILES

CCCCC/C=C\C/C=C\C/C=C\CSCCC(=O)OC

InChI

InChI=1S/C18H30O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-21-17-15-18(19)20-2/h7-8,10-11,13-14H,3-6,9,12,15-17H2,1-2H3/b8-7-,11-10-,14-13-