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Substance Name: 1H-Indole-3-carboxylic acid, 6-bromo-1-(2-hydroxy-3-(4-morpholinyl)propyl)-5-methoxy-2-methyl-, ethyl ester, monohydrochloride
RN: 120342-38-3
InChIKey: PSJLAXUWMLFCPI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-Br-N2-O5.Cl-H

Molecular Weight

  • 491.8072
 
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Names and Synonyms

Synonym

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

Systematic Name

  • 1H-Indole-3-carboxylic acid, 6-bromo-1-(2-hydroxy-3-(4-morpholinyl)propyl)-5-methoxy-2-methyl-, ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 120342-38-3

System Generated Number

  • 0120342383

Molecular Formulas

Molecular Formula

  • C20-H27-Br-N2-O5.Cl-H

Molecular Formula Fragments

  • C20-H27-Br-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27BrN2O5.ClH/c1-4-28-20(25)19-13(2)23(12-14(24)11-22-5-7-27-8-6-22)17-10-16(21)18(26-3)9-15(17)19;/h9-10,14,24H,4-8,11-12H2,1-3H3;1H

InChIKey

PSJLAXUWMLFCPI-UHFFFAOYSA-N

Smiles

CCOC(=O)c1c(n(c2c1cc(c(c2)Br)OC)CC(CN3CCOCC3)O)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 163mg/kg (163mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Pharmaceutical Chemistry Journal Vol. 22, Pg. 631, 1988.