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Substance Name: 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-(1-methylethyl)-3-(2-naphthalenyloxy)-, iodide
RN: 105996-41-6
InChIKey: VGUFXMFOZDVCSN-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N-O2.I

Molecular Weight

  • 415.3084
 
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Names and Synonyms

Synonym

  • 2-Hydroxy-N,N-dimethyl-N-(1-methylethyl)-3-(2-naphthalenyloxy)-1-propanaminium iodide

Systematic Name

  • 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-(1-methylethyl)-3-(2-naphthalenyloxy)-, iodide

Registry Numbers

CAS Registry Number

  • 105996-41-6

System Generated Number

  • 0105996416

Molecular Formulas

Molecular Formula

  • C18-H26-N-O2.I

Molecular Formula Fragments

  • C18-H26-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C18H26NO2.HI/c1-14(2)19(3,4)12-17(20)13-21-18-10-9-15-7-5-6-8-16(15)11-18;/h5-11,14,17,20H,12-13H2,1-4H3;1H/q+1;/p-1

InChIKey

VGUFXMFOZDVCSN-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 70mg/kg (70mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 323, 1986.