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Substance Name: 1H-Indole-3-carboxylic acid, 6-bromo-1-(3-(diethylamino)-2-hydroxypropyl)-5-methoxy-2-methyl-, ethyl ester, monohydrochloride
RN: 120342-37-2
InChIKey: DLERNVHFQLFCSH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-Br-N2-O4.Cl-H

Molecular Weight

  • 477.824
 
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Names and Synonyms

Synonym

  • 1-(3-Diethylamino-2-hydroxypropyl)-2-methyl-3-ethoxycarbonyl-5-methoxy-6-bromoindole HCl

Systematic Name

  • 1H-Indole-3-carboxylic acid, 6-bromo-1-(3-(diethylamino)-2-hydroxypropyl)-5-methoxy-2-methyl-, ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 120342-37-2

System Generated Number

  • 0120342372

Molecular Formulas

Molecular Formula

  • C20-H29-Br-N2-O4.Cl-H

Molecular Formula Fragments

  • C20-H29-Br-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H29BrN2O4.ClH/c1-6-22(7-2)11-14(24)12-23-13(4)19(20(25)27-8-3)15-9-18(26-5)16(21)10-17(15)23;/h9-10,14,24H,6-8,11-12H2,1-5H3;1H

InChIKey

DLERNVHFQLFCSH-UHFFFAOYSA-N

Smiles

CCN(CC)CC(Cn1c(c(c2c1cc(c(c2)OC)Br)C(=O)OCC)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 47mg/kg (47mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Pharmaceutical Chemistry Journal Vol. 22, Pg. 631, 1988.