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Substance Name: 1-Butanone, 1-(4-fluorophenyl)-4-naphthalen-1,4-imin-9-yl-, hydrochloride
RN: 35806-09-8
InChIKey: JKJYUMKEVPZTCO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-F-N-O.Cl-H

Molecular Weight

  • 345.843
 
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Names and Synonyms

Synonym

  • 1-(4-Fluorophenyl)-4-naphthalen-1,4-imin-9-yl-1-butanone hydrochloride

Systematic Name

  • 1-Butanone, 1-(4-fluorophenyl)-4-naphthalen-1,4-imin-9-yl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 35806-09-8

System Generated Number

  • 0035806098

Molecular Formulas

Molecular Formula

  • C20-H20-F-N-O.Cl-H

Molecular Formula Fragments

  • C20-H20-F-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H20FNO.ClH/c21-15-9-7-14(8-10-15)20(23)6-3-13-22-18-11-12-19(22)17-5-2-1-4-16(17)18;/h1-2,4-5,7-10,18-19H,3,6,11-13H2;1H

InChIKey

JKJYUMKEVPZTCO-UHFFFAOYSA-N

Smiles

N1(CCCC(c2ccc(F)cc2)=O)[C@@H]2c3ccccc3[C@@H]1CC2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 1008, 1971.