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Substance Name: Indole-3-carboxylic acid, 1,2-dimethyl-4-((dimethylamino)methyl)-5-hydroxy-, ethyl ester, monohydrochloride
RN: 16200-02-5
InChIKey: DFIHQSOIQJBXFX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-N2-O3.Cl-H

Molecular Weight

  • 326.822
 
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Names and Synonyms

Synonyms

  • 1,2-Dimethyl-3-ethoxycarbonyl-4-dimethylaminomethyl-5-hydroxyindole hydrochloride
  • Ethyl 1,2-dimethyl-4-((dimethylamino)methyl)-5-hydroxyindole-3-carboxylate hydrochloride

Systematic Name

  • Indole-3-carboxylic acid, 1,2-dimethyl-4-((dimethylamino)methyl)-5-hydroxy-, ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 16200-02-5

System Generated Number

  • 0016200025

Molecular Formulas

Molecular Formula

  • C16-H22-N2-O3.Cl-H

Molecular Formula Fragments

  • C16-H22-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H22N2O3.ClH/c1-6-21-16(20)14-10(2)18(5)12-7-8-13(19)11(15(12)14)9-17(3)4;/h7-8,19H,6,9H2,1-5H3;1H

InChIKey

DFIHQSOIQJBXFX-UHFFFAOYSA-N

Smiles

n1(c(c(c2c(c(ccc12)O)CN(C)C)C(=O)OCC)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 33mg/kg (33mg/kg) BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Pharmaceutical Chemistry Journal Vol. 1, Pg. 183, 1967.