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Substance Name: Indole, 2-((diethylamino)methyl)-5-nitro-3-phenyl-, monohydrochloride
RN: 89159-42-2
InChIKey: QXSWEASFEUZMDS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-N3-O2.Cl-H

Molecular Weight

  • 359.8548
 
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Names and Synonyms

Synonyms

  • 1H-Indole-2-methanamine, N,N-diethyl-5-nitro-3-phenyl-, monohydrochloride
  • 2-((Diethylamino)methyl)-5-nitro-3-phenylindole hydrochloride
  • 2-Diethylaminomethyl-3-phenyl-5-nitroindole hydrochloride

Systematic Name

  • Indole, 2-((diethylamino)methyl)-5-nitro-3-phenyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 89159-42-2

System Generated Number

  • 0089159422

Molecular Formulas

Molecular Formula

  • C19-H21-N3-O2.Cl-H

Molecular Formula Fragments

  • C19-H21-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H21N3O2.ClH/c1-3-21(4-2)13-18-19(14-8-6-5-7-9-14)16-12-15(22(23)24)10-11-17(16)20-18;/h5-12,20H,3-4,13H2,1-2H3;1H

InChIKey

QXSWEASFEUZMDS-UHFFFAOYSA-N

Smiles

c1(c(c2c([nH]1)ccc([N+](=O)[O-])c2)c1ccccc1)CN(CC)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 620mg/kg (620mg/kg)   Pharmaceutical Chemistry Journal Vol. 17, Pg. 635, 1983.