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Substance Name: 4-Morpholinepentanoic acid, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, hydrate, endo-
RN: 87168-53-4
InChIKey: QVHRAFMGFVFLAV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H30-N2-O3.2Cl-H.H2-O

Molecular Weight

  • 383.3568
 
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Names and Synonyms

Synonym

  • endo-8-Methyl-8-azabicyclo(3.2.1)oct-3-yl-4-morpholinepentanoate dihydrochloride hydrate

Systematic Name

  • 4-Morpholinepentanoic acid, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, hydrate, endo-

Registry Numbers

CAS Registry Number

  • 87168-53-4

System Generated Number

  • 0087168534

Molecular Formulas

Molecular Formula

  • C17-H30-N2-O3.2Cl-H.H2-O

Molecular Formula Fragments

  • C17-H30-N2-O3
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C17H30N2O3.2ClH/c1-18-14-5-6-15(18)13-16(12-14)22-17(20)4-2-3-7-19-8-10-21-11-9-19;;/h14-16H,2-13H2,1H3;2*1H

InChIKey

QVHRAFMGFVFLAV-UHFFFAOYSA-N

Smiles

CN1C2CCC1CC(C2)OC(=O)CCCCN3CCOCC3.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg)   Pharmaceutical Chemistry Journal Vol. 17, Pg. 345, 1983.