ethyl (2E)-4-methylsulfanyl-2-(octylsulfanylmethylidene)-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-4-methylsulfanyl-2-(octylsulfanylmethylidene)-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-4-methylsulfanyl-2-(octylsulfanylmethylene)-3-oxo-butanoate CAS Name: (2E)-4-(methylthio)-2-[(octylthio)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-4-methylsulfanyl-2-(octylsulfanylmethylidene)-3-oxobutanoate Traditional Name: (E)-2-[2-(methylthio)acetyl]-3-(octylthio)acrylic acid ethyl ester Formula: C16H28O3S2 MolecularWeight: 332.52172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC=C(C(=O)CSC)C(=O)OCC

Isomeric SMILES

CCCCCCCCS/C=C(\C(=O)CSC)/C(=O)OCC

InChI

InChI=1S/C16H28O3S2/c1-4-6-7-8-9-10-11-21-12-14(15(17)13-20-3)16(18)19-5-2/h12H,4-11,13H2,1-3H3/b14-12+