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Substance Name: beta-Alanine, N,N-diethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-
RN: 87168-43-2
InChIKey: IEAXVZSXAWOSEQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H28-N2-O2.2Cl-H

Molecular Weight

  • 341.32
 
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Names and Synonyms

Synonym

  • exo-N,N-Diethyl-beta-alanine 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester dihydrochloride

Systematic Name

  • beta-Alanine, N,N-diethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-

Registry Numbers

CAS Registry Number

  • 87168-43-2

System Generated Number

  • 0087168432

Molecular Formulas

Molecular Formula

  • C15-H28-N2-O2.2Cl-H

Molecular Formula Fragments

  • C15-H28-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H28N2O2.2ClH/c1-4-17(5-2)9-8-15(18)19-14-10-12-6-7-13(11-14)16(12)3;;/h12-14H,4-11H2,1-3H3;2*1H

InChIKey

IEAXVZSXAWOSEQ-UHFFFAOYSA-N

Smiles

CCN(CC)CCC(=O)OC1CC2CCC(C1)N2C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 560mg/kg (560mg/kg)   Pharmaceutical Chemistry Journal Vol. 17, Pg. 345, 1983.