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Substance Name: Piperidinium, 1-((1-(2-benzoylphenoxy)methyl)ethyl)-1-methyl-, iodide
RN: 7347-86-6
InChIKey: WTUFKPWPOXPMIS-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N-O2.I

Molecular Weight

  • 465.368
 
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Names and Synonyms

Synonyms

  • 1-((1-(2-Benzoylphenoxy)methyl)ethyl)-1-methylpiperidinium iodide
  • 2-(2-Piperidinopropoxy)benzophenone methiodide
  • Benzophenone, 2-(2-piperidinopropoxy)-, methiodide

Systematic Name

  • Piperidinium, 1-((1-(2-benzoylphenoxy)methyl)ethyl)-1-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 7347-86-6

System Generated Number

  • 0007347866

Molecular Formulas

Molecular Formula

  • C22-H28-N-O2.I

Molecular Formula Fragments

  • C22-H28-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C22H28NO2.HI/c1-18(23(2)15-9-4-10-16-23)17-25-21-14-8-7-13-20(21)22(24)19-11-5-3-6-12-19;/h3,5-8,11-14,18H,4,9-10,15-17H2,1-2H3;1H/q+1;/p-1

InChIKey

WTUFKPWPOXPMIS-UHFFFAOYSA-M

Smiles

[N+]1(CCCCC1)(C)[C@@H](COc1c(cccc1)C(c1ccccc1)=O)C.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 80mg/kg (80mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 804, 1966.