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Substance Name: 1H-Indole, 3-(1-(cyclopropylmethyl)-1,2,3,6-tetrahydro-4-pyridinyl)-5-nitro-, monohydrochloride
RN: 109793-76-2
InChIKey: OIMQESOYVVCCHB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N3-O2.Cl-H

Molecular Weight

  • 333.817
 
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Names and Synonyms

Synonym

  • 3-(1-(Cyclopropylmethyl)-1,2,3,6-tetrahydro-4-pyridinyl)-5-nitro-1H-indole hydrochloride

Systematic Name

  • 1H-Indole, 3-(1-(cyclopropylmethyl)-1,2,3,6-tetrahydro-4-pyridinyl)-5-nitro-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 109793-76-2

System Generated Number

  • 0109793762

Molecular Formulas

Molecular Formula

  • C17-H19-N3-O2.Cl-H

Molecular Formula Fragments

  • C17-H19-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H19N3O2.ClH/c21-20(22)14-3-4-17-15(9-14)16(10-18-17)13-5-7-19(8-6-13)11-12-1-2-12;/h3-5,9-10,12,18H,1-2,6-8,11H2;1H

InChIKey

OIMQESOYVVCCHB-UHFFFAOYSA-N

Smiles

c12c(C=3CC[N@@H+](CC4CC4)CC3)c[nH]c1ccc(c2)[N+](=O)[O-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: REGIDITY European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 22, Pg. 33, 1987.