Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Atropic acid, 4'-bromo-, 3-tropanyl ester, hydrochloride
RN: 64048-71-1
InChIKey: LCIGZLBQNNATGD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-Br-N-O2.Cl-H

Molecular Weight

  • 386.715
 
* 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

Synonyms

  • 3-Tropanyl 4'-bromoatropate hydrochloride
  • 4'-Bromoatropic acid, 3-tropanyl ester, hydrochloride

Systematic Name

  • Atropic acid, 4'-bromo-, 3-tropanyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 64048-71-1

System Generated Number

  • 0064048711

Molecular Formulas

Molecular Formula

  • C17-H20-Br-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H20-Br-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H20BrNO2.ClH/c1-11(12-3-5-13(18)6-4-12)17(20)21-16-9-14-7-8-15(10-16)19(14)2;/h3-6,14-16H,1,7-10H2,2H3;1H

InChIKey

LCIGZLBQNNATGD-UHFFFAOYSA-N

Smiles

C1(C[C@@H]2[NH+](C)[C@@H](C1)CC2)OC(C(c1ccc(Br)cc1)=C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 384mg/kg (384mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 477, 1969.