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Substance Name: Benzamide, N-(8-(phenylmethyl)-8-azabicyclo(3.2.1)oct-3-yl)-2,3,4-trimethoxy-, hydrochloride,hydrate (5:5:3), exo-
RN: 76352-12-0
InChIKey: MWXKECQZBUPHIO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H30-N2-O4.Cl-H.3/5H2-O

Molecular Weight

  • 446.9719
 
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Names and Synonyms

Synonym

  • exo-N-(8-Benzyl-8-azabicyclo(3.2.1)oct-3-yl)-2,3,4-trimethoxybenzamide hydrochloride

Systematic Name

  • Benzamide, N-(8-(phenylmethyl)-8-azabicyclo(3.2.1)oct-3-yl)-2,3,4-trimethoxy-, hydrochloride,hydrate (5:5:3), exo-

Registry Numbers

CAS Registry Number

  • 76352-12-0

System Generated Number

  • 0076352120

Molecular Formulas

Molecular Formula

  • C24-H30-N2-O4.Cl-H.3/5H2-O

Molecular Formula Fragments

  • C24-H30-N2-O4
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C24H30N2O4.ClH/c1-28-21-12-11-20(22(29-2)23(21)30-3)24(27)25-17-13-18-9-10-19(14-17)26(18)15-16-7-5-4-6-8-16;/h4-8,11-12,17-19H,9-10,13-15H2,1-3H3,(H,25,27);1H

InChIKey

MWXKECQZBUPHIO-UHFFFAOYSA-N

Smiles

COc1ccc(c(c1OC)OC)C(=O)NC2CC3CCC(C2)N3Cc4ccccc4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 80mg/kg (80mg/kg)   United States Patent Document. Vol. #4321378,