2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylethanoate

Systemtic Name: 2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylethanoate Openeye Name: 2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylacetate CAS Name: 2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]acetate IUPAC Name: 2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylacetate Traditional Name: 2-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]acetate Formula: C17H27O2S- MolecularWeight: 295.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCSCC(=O)[O-])C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CSCC(=O)[O-])/C)/C)C

InChI

InChI=1S/C17H28O2S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-20-13-17(18)19/h7,9,11H,5-6,8,10,12-13H2,1-4H3,(H,18,19)/p-1/b15-9+,16-11+