ethyl (2E,4E)-6-ethanoylsulfanyl-3-ethoxy-hepta-2,4-dienoate

Systemtic Name: ethyl (2E,4E)-6-ethanoylsulfanyl-3-ethoxy-hepta-2,4-dienoate Openeye Name: ethyl (2E,4E)-6-acetylsulfanyl-3-ethoxy-hepta-2,4-dienoate CAS Name: (2E,4E)-6-(acetylthio)-3-ethoxyhepta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4E)-6-acetylsulfanyl-3-ethoxyhepta-2,4-dienoate Traditional Name: (2E,4E)-6-(acetylthio)-3-ethoxy-hepta-2,4-dienoic acid ethyl ester Formula: C13H20O4S MolecularWeight: 272.3605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O4S/c1-5-16-12(9-13(15)17-6-2)8-7-10(3)18-11(4)14/h7-10H,5-6H2,1-4H3/b8-7+,12-9+