diethyl 2-[(E)-6-methylsulfanylhex-3-en-2-yl]propanedioate

Systemtic Name: diethyl 2-[(E)-6-methylsulfanylhex-3-en-2-yl]propanedioate Openeye Name: diethyl 2-[(E)-1-methyl-5-methylsulfanyl-pent-2-enyl]propanedioate CAS Name: 2-[(E)-6-(methylthio)hex-3-en-2-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-6-methylsulfanylhex-3-en-2-yl]propanedioate Traditional Name: 2-[(E)-1-methyl-5-(methylthio)pent-2-enyl]malonic acid diethyl ester Formula: C14H24O4S MolecularWeight: 288.40296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C=CCCSC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C)/C=C/CCSC)C(=O)OCC

InChI

InChI=1S/C14H24O4S/c1-5-17-13(15)12(14(16)18-6-2)11(3)9-7-8-10-19-4/h7,9,11-12H,5-6,8,10H2,1-4H3/b9-7+