Chemical Compound

Cocaine N-Oxide

CAS Registry Number 72182-46-8
Cocaine N-Oxide chemical structure
Primary Record

Cocaine N-Oxide

In stock
8,487 g
Purity
98.9 %
CAS
72182-46-8

Compound Identifiers & Properties

CAS
72182-46-8
PubChem CID
156037
SMILES
C[N+]1([C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)C3=CC=CC=C3)C(=O)OC)[O-]
Canonical SMILES
COC(=O)[C@H]1[C@@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1[N+]2(C)[O-]

Names & Synonyms

  • Cocaine N-Oxide
  • RefChem:311753
  • AC1L4FG0
  • CTK2I0594
  • DTXSID90992900
  • ZINC6068321
  • CID156037
  • 72182-46-8
  • J1.066.254K
  • 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-,methyl ester, 8-oxide, (1R,2R,3S,5S)-
  • Methyl (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-oxido-8-azoniabicyclo[3.2.1]octane-2-carboxylate
  • Methyl 3-(benzoyloxy)-8-methyl-8-oxo-8lambda~5~-azabicyclo[3.2.1]octane-2-carboxylate
  • (1R,2R,3S,5S)-3-(BENZOYLOXY)-2-(METHOXYCARBONYL)-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-8-IUM-8-OLATE
  • (1R,5S)-3beta-(Benzoyloxy)-8-methyl-8-oxylato-8-azoniabicyclo[3.2.1]octane-2beta-carboxylic acid methyl ester
  • Methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-oxo-8lambda~5~-azabicyclo[3.2.1]octane-2-carboxylate
  • methyl (1S,3S,4R,5R)-3-benzoyloxy-8-methyl-8-oxido-8-azoniabicyclo[3.2.1]octane-4-carboxylate