methyl 2-methyl-2-[(E)-2-methylsulfanylethenyl]-5-oxidanylidene-hexanoate

Systemtic Name: methyl 2-methyl-2-[(E)-2-methylsulfanylethenyl]-5-oxidanylidene-hexanoate Openeye Name: methyl 2-methyl-2-[(E)-2-methylsulfanylvinyl]-5-oxo-hexanoate CAS Name: 2-methyl-2-[(E)-2-(methylthio)ethenyl]-5-oxohexanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[(E)-2-methylsulfanylethenyl]-5-oxohexanoate Traditional Name: (E)-2-(3-ketobutyl)-2-methyl-4-(methylthio)but-3-enoic acid methyl ester Formula: C11H18O3S MolecularWeight: 230.32382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C)(C=CSC)C(=O)OC

Isomeric SMILES

CC(=O)CCC(C)(/C=C/SC)C(=O)OC

InChI

InChI=1S/C11H18O3S/c1-9(12)5-6-11(2,7-8-15-4)10(13)14-3/h7-8H,5-6H2,1-4H3/b8-7+