(5,5-dimethyl-2-methylsulfanyl-3-oxidanylidene-cyclohexen-1-yl) ethanoate

Systemtic Name: (5,5-dimethyl-2-methylsulfanyl-3-oxidanylidene-cyclohexen-1-yl) ethanoate Openeye Name: (5,5-dimethyl-2-methylsulfanyl-3-oxo-cyclohexen-1-yl) acetate CAS Name: acetic acid [5,5-dimethyl-2-(methylthio)-3-oxo-1-cyclohexenyl] ester IUPAC Name: (5,5-dimethyl-2-methylsulfanyl-3-oxocyclohexen-1-yl) acetate Traditional Name: acetic acid [3-keto-5,5-dimethyl-2-(methylthio)cyclohexen-1-yl] ester Formula: C11H16O3S MolecularWeight: 228.30794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=O)CC(C1)(C)C)SC

Isomeric SMILES

CC(=O)OC1=C(C(=O)CC(C1)(C)C)SC

InChI

InChI=1S/C11H16O3S/c1-7(12)14-9-6-11(2,3)5-8(13)10(9)15-4/h5-6H2,1-4H3