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Substance Name: Butyrophenone, 4'-fluoro-4-(4-(p-anisyl)cyclohexylamino)-, hydrochloride, (E)-
RN: 40553-75-1
InChIKey: AVOYXDNJDONWLN-UHFFFAOYSA-N

Molecular Formula

  • C23-H28-F-N-O2.Cl-H

Molecular Weight

  • 405.938
 
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Names and Synonyms

Synonym

  • trans-4'-Fluoro-4-(4-(p-anisyl)cyclohexylamino)butyrophenone hydrochloride

Systematic Name

  • Butyrophenone, 4'-fluoro-4-(4-(p-anisyl)cyclohexylamino)-, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 40553-75-1

System Generated Number

  • 0040553751

Molecular Formulas

Molecular Formula

  • C23-H28-F-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H28-F-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H28FNO2.ClH/c1-27-22-14-8-18(9-15-22)17-6-12-21(13-7-17)25-16-2-3-23(26)19-4-10-20(24)11-5-19;/h4-5,8-11,14-15,17,21,25H,2-3,6-7,12-13,16H2,1H3;1H

InChIKey

AVOYXDNJDONWLN-UHFFFAOYSA-N

Smiles

C1(c2ccc(OC)cc2)CCC([NH2+]CCCC(c2ccc(F)cc2)=O)CC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 178mg/kg (178mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1239, 1972.