2-sulfanyloctan-3-yl ethanoate

Systemtic Name: 2-sulfanyloctan-3-yl ethanoate Openeye Name: 1-(1-sulfanylethyl)hexyl acetate CAS Name: acetic acid 2-mercaptooctan-3-yl ester IUPAC Name: 2-sulfanyloctan-3-yl acetate Traditional Name: acetic acid 1-(1-mercaptoethyl)hexyl ester Formula: C10H20O2S MolecularWeight: 204.3296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)S)OC(=O)C

Isomeric SMILES

CCCCCC(C(C)S)OC(=O)C

InChI

InChI=1S/C10H20O2S/c1-4-5-6-7-10(8(2)13)12-9(3)11/h8,10,13H,4-7H2,1-3H3