Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Piperidinium, 1-(4-hydroxy-4-phenyl-4-(2-pyridyl)-2-butynyl)-1-methyl-, bromide
RN: 2110-54-5
InChIKey: MDMZSLREGOUIFR-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N2-O.Br

Molecular Weight

  • 401.345
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 1-(4-Hydroxy-4-phenyl-4-(2-pyridyl)-2-butynyl)-1-methylpiperidinium bromide

Systematic Name

  • Piperidinium, 1-(4-hydroxy-4-phenyl-4-(2-pyridyl)-2-butynyl)-1-methyl-, bromide

Registry Numbers

CAS Registry Number

  • 2110-54-5

System Generated Number

  • 0002110545

Molecular Formulas

Molecular Formula

  • C21-H25-N2-O.Br

Molecular Formula Fragments

  • Br
  • C21-H25-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N2O.BrH/c1-23(16-8-3-9-17-23)18-10-14-21(24,19-11-4-2-5-12-19)20-13-6-7-15-22-20;/h2,4-7,11-13,15,24H,3,8-9,16-18H2,1H3;1H/q+1;/p-1

InChIKey

MDMZSLREGOUIFR-UHFFFAOYSA-M

Smiles

[N+]1(CCCCC1)(C)CC#C[C@@](c1ccccn1)(c1ccccc1)O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 300mg/kg (300mg/kg)   Acta Pharmaceutica Suecica. Vol. 1, Pg. 237, 1964.