ethyl (3E,5E)-6-ethoxy-6-oxidanyl-2-oxidanylidene-5-prop-2-enylsulfanyl-hexa-3,5-dienoate

Systemtic Name: ethyl (3E,5E)-6-ethoxy-6-oxidanyl-2-oxidanylidene-5-prop-2-enylsulfanyl-hexa-3,5-dienoate Openeye Name: ethyl (3E,5E)-5-allylsulfanyl-6-ethoxy-6-hydroxy-2-oxo-hexa-3,5-dienoate CAS Name: (3E,5E)-6-ethoxy-6-hydroxy-2-oxo-5-(prop-2-enylthio)hexa-3,5-dienoic acid ethyl ester IUPAC Name: ethyl (3E,5E)-6-ethoxy-6-hydroxy-2-oxo-5-prop-2-enylsulfanylhexa-3,5-dienoate Traditional Name: (3E,5E)-5-(allylthio)-6-ethoxy-6-hydroxy-2-keto-hexa-3,5-dienoic acid ethyl ester Formula: C13H18O5S MolecularWeight: 286.34402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C(=C(\C=C\C(=O)C(=O)OCC)/SCC=C)/O

InChI

InChI=1S/C13H18O5S/c1-4-9-19-11(13(16)18-6-3)8-7-10(14)12(15)17-5-2/h4,7-8,16H,1,5-6,9H2,2-3H3/b8-7+,13-11+