5-methylsulfanyloctanoate

Systemtic Name: 5-methylsulfanyloctanoate Openeye Name: 5-methylsulfanyloctanoate CAS Name: 5-(methylthio)octanoate IUPAC Name: 5-methylsulfanyloctanoate Traditional Name: 5-(methylthio)caprylate Formula: C9H17O2S- MolecularWeight: 189.29508

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCC(=O)[O-])SC

Isomeric SMILES

CCCC(CCCC(=O)[O-])SC

InChI

InChI=1S/C9H18O2S/c1-3-5-8(12-2)6-4-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)/p-1