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Substance Name: Methanone, (3-(6,8-dioxa-3-azabicyclo(3.2.1)oct-5-yl)phenyl)phenyl-, hydrochloride
RN: 84508-87-2
InChIKey: WAXDADOMWXRTCO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-N-O3.Cl-H

Molecular Weight

  • 331.7972
 
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Names and Synonyms

Synonyms

  • (3-(6,8-Dioxa-3-azabicyclo(3.2.1)oct-5-yl)phenyl)phenylmethanone hydrochloride
  • 5-(meta-Benzoyl)phenyl-3-aza-6,8-dioxabicyclo(3.2.1)octane chlorhydrate

Systematic Name

  • Methanone, (3-(6,8-dioxa-3-azabicyclo(3.2.1)oct-5-yl)phenyl)phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 84508-87-2

System Generated Number

  • 0084508872

Molecular Formulas

Molecular Formula

  • C18-H17-N-O3.Cl-H

Molecular Formula Fragments

  • C18-H17-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H17NO3.ClH/c20-17(13-5-2-1-3-6-13)14-7-4-8-15(9-14)18-12-19-10-16(22-18)11-21-18;/h1-9,16,19H,10-12H2;1H

InChIKey

WAXDADOMWXRTCO-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)c2cccc(c2)C34CNCC(O3)CO4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 155mg/kg (155mg/kg)   United States Patent Document. Vol. #4463004,