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

Systemtic Name: [5-(1-ethylsulfanylcyclopentyl)-3-oxidanylidene-cyclohexen-1-yl] butanoate Openeye Name: [5-(1-ethylsulfanylcyclopentyl)-3-oxo-cyclohexen-1-yl] butanoate CAS Name: butanoic acid [5-[1-(ethylthio)cyclopentyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(1-ethylsulfanylcyclopentyl)-3-oxocyclohexen-1-yl] butanoate Traditional Name: butyric acid [5-[1-(ethylthio)cyclopentyl]-3-keto-cyclohexen-1-yl] ester Formula: C17H26O3S MolecularWeight: 310.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O3S/c1-3-7-16(19)20-15-11-13(10-14(18)12-15)17(21-4-2)8-5-6-9-17/h12-13H,3-11H2,1-2H3