[2,2-bis(methylsulfanyl)-1-(2-oxidanylidenecyclohexyl)ethyl] ethanoate

Systemtic Name: [2,2-bis(methylsulfanyl)-1-(2-oxidanylidenecyclohexyl)ethyl] ethanoate Openeye Name: [2,2-bis(methylsulfanyl)-1-(2-oxocyclohexyl)ethyl] acetate CAS Name: acetic acid [2,2-bis(methylthio)-1-(2-oxocyclohexyl)ethyl] ester IUPAC Name: [2,2-bis(methylsulfanyl)-1-(2-oxocyclohexyl)ethyl] acetate Traditional Name: acetic acid [1-(2-ketocyclohexyl)-2,2-bis(methylthio)ethyl] ester Formula: C12H20O3S2 MolecularWeight: 276.4154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1CCCCC1=O)C(SC)SC

Isomeric SMILES

CC(=O)OC(C1CCCCC1=O)C(SC)SC

InChI

InChI=1S/C12H20O3S2/c1-8(13)15-11(12(16-2)17-3)9-6-4-5-7-10(9)14/h9,11-12H,4-7H2,1-3H3