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Substance Name: 2-Propen-1-aminium, N-(2-hydroxy-3-(2-naphthalenyloxy)propyl)-N,N-dimethyl-, bromide
RN: 105996-43-8
InChIKey: PBEZIXSAYYZZNZ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-N-O2.Br

Molecular Weight

  • 366.2966
 
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Names and Synonyms

Synonym

  • N-(2-Hydroxy-3-(2-naphthalenyloxy)propyl)-N,N-dimethyl-2-propen-1-aminium bromide

Systematic Name

  • 2-Propen-1-aminium, N-(2-hydroxy-3-(2-naphthalenyloxy)propyl)-N,N-dimethyl-, bromide

Registry Numbers

CAS Registry Number

  • 105996-43-8

System Generated Number

  • 0105996438

Molecular Formulas

Molecular Formula

  • C18-H24-N-O2.Br

Molecular Formula Fragments

  • Br
  • C18-H24-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C18H24NO2.BrH/c1-4-11-19(2,3)13-17(20)14-21-18-10-9-15-7-5-6-8-16(15)12-18;/h4-10,12,17,20H,1,11,13-14H2,2-3H3;1H/q+1;/p-1

InChIKey

PBEZIXSAYYZZNZ-UHFFFAOYSA-M

Smiles

C[N+](C)(CC=C)CC(COc1ccc2ccccc2c1)O.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 36200ug/kg (36.2mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 323, 1986.