S-(2,6-dimethyl-6-oxidanyl-octan-3-yl) ethanethioate

Systemtic Name: S-(2,6-dimethyl-6-oxidanyl-octan-3-yl) ethanethioate Openeye Name: S-(4-hydroxy-1-isopropyl-4-methyl-hexyl) ethanethioate CAS Name: ethanethioic acid S-(6-hydroxy-2,6-dimethyloctan-3-yl) ester IUPAC Name: S-(6-hydroxy-2,6-dimethyloctan-3-yl) ethanethioate Traditional Name: ethanethioic acid S-(4-hydroxy-1-isopropyl-4-methyl-hexyl) ester Formula: C12H24O2S MolecularWeight: 232.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCC(C(C)C)SC(=O)C)O

Isomeric SMILES

CCC(C)(CCC(C(C)C)SC(=O)C)O

InChI

InChI=1S/C12H24O2S/c1-6-12(5,14)8-7-11(9(2)3)15-10(4)13/h9,11,14H,6-8H2,1-5H3