methyl 6-ethyl-9-methylsulfanyl-7-oxidanylidene-5-sulfanyl-nonanoate

Systemtic Name: methyl 6-ethyl-9-methylsulfanyl-7-oxidanylidene-5-sulfanyl-nonanoate Openeye Name: methyl 6-ethyl-9-methylsulfanyl-7-oxo-5-sulfanyl-nonanoate CAS Name: 6-ethyl-5-mercapto-9-(methylthio)-7-oxononanoic acid methyl ester IUPAC Name: methyl 6-ethyl-9-methylsulfanyl-7-oxo-5-sulfanylnonanoate Traditional Name: 6-ethyl-7-keto-5-mercapto-9-(methylthio)pelargonic acid methyl ester Formula: C13H24O3S2 MolecularWeight: 292.45786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCCC(=O)OC)S)C(=O)CCSC

Isomeric SMILES

CCC(C(CCCC(=O)OC)S)C(=O)CCSC

InChI

InChI=1S/C13H24O3S2/c1-4-10(11(14)8-9-18-3)12(17)6-5-7-13(15)16-2/h10,12,17H,4-9H2,1-3H3