(1-methylsulfanyl-1-oxidanylidene-nonan-2-yl) ethanoate

Systemtic Name: (1-methylsulfanyl-1-oxidanylidene-nonan-2-yl) ethanoate Openeye Name: 1-methylsulfanylcarbonyloctyl acetate CAS Name: acetic acid [1-(methylthio)-1-oxononan-2-yl] ester IUPAC Name: (1-methylsulfanyl-1-oxononan-2-yl) acetate Traditional Name: acetic acid 1-(methylthio)carbonyloctyl ester Formula: C12H22O3S MolecularWeight: 246.36628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(=O)SC)OC(=O)C

Isomeric SMILES

CCCCCCCC(C(=O)SC)OC(=O)C

InChI

InChI=1S/C12H22O3S/c1-4-5-6-7-8-9-11(12(14)16-3)15-10(2)13/h11H,4-9H2,1-3H3