[5-(1-methylsulfanylcyclopentyl)-3-oxidanylidene-cyclohexen-1-yl] butanoate

Systemtic Name: [5-(1-methylsulfanylcyclopentyl)-3-oxidanylidene-cyclohexen-1-yl] butanoate Openeye Name: [5-(1-methylsulfanylcyclopentyl)-3-oxo-cyclohexen-1-yl] butanoate CAS Name: butanoic acid [5-[1-(methylthio)cyclopentyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(1-methylsulfanylcyclopentyl)-3-oxocyclohexen-1-yl] butanoate Traditional Name: butyric acid [3-keto-5-[1-(methylthio)cyclopentyl]cyclohexen-1-yl] ester Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC(=O)CC(C1)C2(CCCC2)SC

Isomeric SMILES

CCCC(=O)OC1=CC(=O)CC(C1)C2(CCCC2)SC

InChI

InChI=1S/C16H24O3S/c1-3-6-15(18)19-14-10-12(9-13(17)11-14)16(20-2)7-4-5-8-16/h11-12H,3-10H2,1-2H3