methyl 3-hexylsulfanyl-2-methyl-butanoate

Systemtic Name: methyl 3-hexylsulfanyl-2-methyl-butanoate Openeye Name: methyl 3-hexylsulfanyl-2-methyl-butanoate CAS Name: 3-(hexylthio)-2-methylbutanoic acid methyl ester IUPAC Name: methyl 3-hexylsulfanyl-2-methylbutanoate Traditional Name: 3-(hexylthio)-2-methyl-butyric acid methyl ester Formula: C12H24O2S MolecularWeight: 232.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(C)C(C)C(=O)OC

Isomeric SMILES

CCCCCCSC(C)C(C)C(=O)OC

InChI

InChI=1S/C12H24O2S/c1-5-6-7-8-9-15-11(3)10(2)12(13)14-4/h10-11H,5-9H2,1-4H3