[(2E)-3,7-dimethylocta-2,6-dienyl] 2-sulfanylethanoate

Systemtic Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-sulfanylethanoate Openeye Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester IUPAC Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester Formula: C12H20O2S MolecularWeight: 228.351

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOC(=O)CS)C)C

Isomeric SMILES

CC(=CCC/C(=C/COC(=O)CS)/C)C

InChI

InChI=1S/C12H20O2S/c1-10(2)5-4-6-11(3)7-8-14-12(13)9-15/h5,7,15H,4,6,8-9H2,1-3H3/b11-7+