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Substance Name: 1-Butanone, 4-(1-(3-hydroxyphenyl)-6-azabicyclo(3.2.1)oct-6-yl)-1-phenyl-, hydrochloride, (+-)-
RN: 61098-71-3
InChIKey: LRUKTDURLVAPHW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-N-O2.Cl-H

Molecular Weight

  • 385.9322
 
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Names and Synonyms

  • 1-Butanone, 4-(1-(3-hydroxyphenyl)-6-azabicyclo(3.2.1)oct-6-yl)-1-phenyl-, hydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 61098-71-3

System Generated Number

  • 0061098713

Molecular Formulas

Molecular Formula

  • C23-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H27NO2.ClH/c25-21-11-4-9-19(15-21)23-13-5-10-20(16-23)24(17-23)14-6-12-22(26)18-7-2-1-3-8-18;/h1-4,7-9,11,15,20,25H,5-6,10,12-14,16-17H2;1H

InChIKey

LRUKTDURLVAPHW-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)CCCN2CC3(CCCC2C3)c4cccc(c4)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 221, 1977.