methyl 2,2-dimethyl-5-methylsulfanyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 2,2-dimethyl-5-methylsulfanyl-4-oxidanylidene-pentanoate Openeye Name: methyl 2,2-dimethyl-5-methylsulfanyl-4-oxo-pentanoate CAS Name: 2,2-dimethyl-5-(methylthio)-4-oxopentanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-5-methylsulfanyl-4-oxopentanoate Traditional Name: 4-keto-2,2-dimethyl-5-(methylthio)valeric acid methyl ester Formula: C9H16O3S MolecularWeight: 204.28654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)CSC)C(=O)OC

Isomeric SMILES

CC(C)(CC(=O)CSC)C(=O)OC

InChI

InChI=1S/C9H16O3S/c1-9(2,8(11)12-3)5-7(10)6-13-4/h5-6H2,1-4H3