pentyl 4-methylsulfanyl-2-oxidanyl-butanoate

Systemtic Name: pentyl 4-methylsulfanyl-2-oxidanyl-butanoate Openeye Name: pentyl 2-hydroxy-4-methylsulfanyl-butanoate CAS Name: 2-hydroxy-4-(methylthio)butanoic acid pentyl ester IUPAC Name: pentyl 2-hydroxy-4-methylsulfanylbutanoate Traditional Name: 2-hydroxy-4-(methylthio)butyric acid amyl ester Formula: C10H20O3S MolecularWeight: 220.329

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCSC)O

Isomeric SMILES

CCCCCOC(=O)C(CCSC)O

InChI

InChI=1S/C10H20O3S/c1-3-4-5-7-13-10(12)9(11)6-8-14-2/h9,11H,3-8H2,1-2H3