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Substance Name: 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7,8-dimethyl-4-piperidino-, hydrochloride
RN: 56071-18-2
InChIKey: PKPLQPRDYKPHNC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N-O2.Cl-H

Molecular Weight

  • 309.835
 
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Names and Synonyms

Synonym

  • 4-(1-Piperidino)-7,8-dimethyl-3,4-dihydro-1-benzoxepin-5(2H)-one hydrochloride

Systematic Name

  • 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7,8-dimethyl-4-piperidino-, hydrochloride

Registry Numbers

CAS Registry Number

  • 56071-18-2

System Generated Number

  • 0056071182

Molecular Formulas

Molecular Formula

  • C17-H23-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H23-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H23NO2.ClH/c1-12-10-14-16(11-13(12)2)20-9-6-15(17(14)19)18-7-4-3-5-8-18;/h10-11,15H,3-9H2,1-2H3;1H

InChIKey

PKPLQPRDYKPHNC-UHFFFAOYSA-N

Smiles

c12c(cc(C)c(c2)C)OCC[C@@H](C1=O)[NH+]1CCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Indian Journal of Chemistry. Vol. 13, Pg. 1, 1975.