diethyl 2-(5-methyl-1-methylsulfanyl-hex-4-en-3-yl)propanedioate

Systemtic Name: diethyl 2-(5-methyl-1-methylsulfanyl-hex-4-en-3-yl)propanedioate Openeye Name: diethyl 2-[3-methyl-1-(2-methylsulfanylethyl)but-2-enyl]propanedioate CAS Name: 2-[5-methyl-1-(methylthio)hex-4-en-3-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(5-methyl-1-methylsulfanylhex-4-en-3-yl)propanedioate Traditional Name: 2-[3-methyl-1-[2-(methylthio)ethyl]but-2-enyl]malonic acid diethyl ester Formula: C15H26O4S MolecularWeight: 302.42954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26O4S/c1-6-18-14(16)13(15(17)19-7-2)12(8-9-20-5)10-11(3)4/h10,12-13H,6-9H2,1-5H3