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Substance Name: 1-Butanone, 1-(4-fluorophenyl)-4-(1-(3-hydroxyphenyl)-6-azabicyclo(3.2.1)oct-6-yl)-, hydrochloride, (+-)-
RN: 61098-72-4
InChIKey: ORIISXAFLPTPLD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-F-N-O2.Cl-H

Molecular Weight

  • 403.9223
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 61098-72-4

System Generated Number

  • 0061098724

Molecular Formulas

Molecular Formula

  • C23-H26-F-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H26-F-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H26FNO2.ClH/c24-19-10-8-17(9-11-19)22(27)7-3-13-25-16-23(12-2-5-20(25)15-23)18-4-1-6-21(26)14-18;/h1,4,6,8-11,14,20,26H,2-3,5,7,12-13,15-16H2;1H

InChIKey

ORIISXAFLPTPLD-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)O)C23CCCC(C2)N(C3)CCCC(=O)c4ccc(cc4)F.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.