ethyl (3E,5E)-2-ethanoylsulfanyl-2-methyl-deca-3,5-dienoate

Systemtic Name: ethyl (3E,5E)-2-ethanoylsulfanyl-2-methyl-deca-3,5-dienoate Openeye Name: ethyl (3E,5E)-2-acetylsulfanyl-2-methyl-deca-3,5-dienoate CAS Name: (3E,5E)-2-(acetylthio)-2-methyldeca-3,5-dienoic acid ethyl ester IUPAC Name: ethyl (3E,5E)-2-acetylsulfanyl-2-methyldeca-3,5-dienoate Traditional Name: (3E,5E)-2-(acetylthio)-2-methyl-deca-3,5-dienoic acid ethyl ester Formula: C15H24O3S MolecularWeight: 284.41426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC=CC(C)(C(=O)OCC)SC(=O)C

Isomeric SMILES

CCCC/C=C/C=C/C(C)(C(=O)OCC)SC(=O)C

InChI

InChI=1S/C15H24O3S/c1-5-7-8-9-10-11-12-15(4,19-13(3)16)14(17)18-6-2/h9-12H,5-8H2,1-4H3/b10-9+,12-11+