sulfanylmethyl octanoate

Systemtic Name: sulfanylmethyl octanoate Openeye Name: sulfanylmethyl octanoate CAS Name: octanoic acid mercaptomethyl ester IUPAC Name: sulfanylmethyl octanoate Traditional Name: caprylic acid mercaptomethyl ester Formula: C9H18O2S MolecularWeight: 190.30302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCS

Isomeric SMILES

CCCCCCCC(=O)OCS

InChI

InChI=1S/C9H18O2S/c1-2-3-4-5-6-7-9(10)11-8-12/h12H,2-8H2,1H3