methyl 2-(methylsulfanylmethyl)-3-oxidanyl-hexanoate

Systemtic Name: methyl 2-(methylsulfanylmethyl)-3-oxidanyl-hexanoate Openeye Name: methyl 3-hydroxy-2-(methylsulfanylmethyl)hexanoate CAS Name: 3-hydroxy-2-[(methylthio)methyl]hexanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-(methylsulfanylmethyl)hexanoate Traditional Name: 3-hydroxy-2-[(methylthio)methyl]hexanoic acid methyl ester Formula: C9H18O3S MolecularWeight: 206.30242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CSC)C(=O)OC)O

Isomeric SMILES

CCCC(C(CSC)C(=O)OC)O

InChI

InChI=1S/C9H18O3S/c1-4-5-8(10)7(6-13-3)9(11)12-2/h7-8,10H,4-6H2,1-3H3