2-sulfanylethyl (9E,12E,15E)-octadeca-9,12,15-trienoate

Systemtic Name: 2-sulfanylethyl (9E,12E,15E)-octadeca-9,12,15-trienoate Openeye Name: 2-sulfanylethyl (9E,12E,15E)-octadeca-9,12,15-trienoate CAS Name: (9E,12E,15E)-octadeca-9,12,15-trienoic acid 2-mercaptoethyl ester IUPAC Name: 2-sulfanylethyl (9E,12E,15E)-octadeca-9,12,15-trienoate Traditional Name: (9E,12E,15E)-octadeca-9,12,15-trienoic acid 2-mercaptoethyl ester Formula: C20H34O2S MolecularWeight: 338.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCCC(=O)OCCS

Isomeric SMILES

CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)OCCS

InChI

InChI=1S/C20H34O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)22-18-19-23/h3-4,6-7,9-10,23H,2,5,8,11-19H2,1H3/b4-3+,7-6+,10-9+