methyl 2-methyl-9-methylsulfanyl-9-oxidanylidene-nonanoate

Systemtic Name: methyl 2-methyl-9-methylsulfanyl-9-oxidanylidene-nonanoate Openeye Name: methyl 2-methyl-9-methylsulfanyl-9-oxo-nonanoate CAS Name: 2-methyl-9-(methylthio)-9-oxononanoic acid methyl ester IUPAC Name: methyl 2-methyl-9-methylsulfanyl-9-oxononanoate Traditional Name: 9-keto-2-methyl-9-(methylthio)pelargonic acid methyl ester Formula: C12H22O3S MolecularWeight: 246.36628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O3S/c1-10(12(14)15-2)8-6-4-5-7-9-11(13)16-3/h10H,4-9H2,1-3H3