[3-methyl-1,1-bis(methylsulfanyl)-4-oxidanylidene-hexan-2-yl] ethanoate

Systemtic Name: [3-methyl-1,1-bis(methylsulfanyl)-4-oxidanylidene-hexan-2-yl] ethanoate Openeye Name: [1-[bis(methylsulfanyl)methyl]-2-methyl-3-oxo-pentyl] acetate CAS Name: acetic acid [3-methyl-1,1-bis(methylthio)-4-oxohexan-2-yl] ester IUPAC Name: [3-methyl-1,1-bis(methylsulfanyl)-4-oxohexan-2-yl] acetate Traditional Name: acetic acid [1-[bis(methylthio)methyl]-3-keto-2-methyl-pentyl] ester Formula: C11H20O3S2 MolecularWeight: 264.4047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O3S2/c1-6-9(13)7(2)10(14-8(3)12)11(15-4)16-5/h7,10-11H,6H2,1-5H3