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

Systemtic Name: methyl 3-[(2Z,5Z)-tetradeca-2,5-dienyl]sulfanylpropanoate Openeye Name: methyl 3-[(2Z,5Z)-tetradeca-2,5-dienyl]sulfanylpropanoate CAS Name: 3-[[(2Z,5Z)-tetradeca-2,5-dienyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2Z,5Z)-tetradeca-2,5-dienyl]sulfanylpropanoate Traditional Name: 3-[[(2Z,5Z)-tetradeca-2,5-dienyl]thio]propionic acid methyl ester Formula: C18H32O2S MolecularWeight: 312.51048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCC=CCSCCC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H32O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-21-17-15-18(19)20-2/h10-11,13-14H,3-9,12,15-17H2,1-2H3/b11-10-,14-13-