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Substance Name: 2H-Pyrido(3,4-b)indole-2-ethanol, 1,3,4,9-tetrahydro-1-(3,4-dimethoxyphenyl)-alpha-((methylamino)methyl)-, dihydrochloride
RN: 111050-85-2
InChIKey: XIVPHEZVUPCHCD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N3-O3.2Cl-H

Molecular Weight

  • 468.4219
 
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Names and Synonyms

  • 2H-Pyrido(3,4-b)indole-2-ethanol, 1,3,4,9-tetrahydro-1-(3,4-dimethoxyphenyl)-alpha-((methylamino)methyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 111050-85-2

System Generated Number

  • 0111050852

Molecular Formulas

Molecular Formula

  • C23-H29-N3-O3.2Cl-H

Molecular Formula Fragments

  • C23-H29-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H29N3O3.2ClH/c1-24-13-16(27)14-26-11-10-18-17-6-4-5-7-19(17)25-22(18)23(26)15-8-9-20(28-2)21(12-15)29-3;;/h4-9,12,16,23-25,27H,10-11,13-14H2,1-3H3;2*1H

InChIKey

XIVPHEZVUPCHCD-UHFFFAOYSA-N

Smiles

CNCC(CN1CCc2c3ccccc3[nH]c2C1c4ccc(c(c4)OC)OC)O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 235mg/kg (235mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 414, 1987.