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Substance Name: Indole-3-carboxylic acid, 6-bromo-5-hydroxy-2-(morpholinomethyl)-1-phenyl-, ethyl ester, hydrochloride
RN: 88461-88-5
InChIKey: SOSYXINOWQRFOZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H23-Br-N2-O4.Cl-H

Molecular Weight

  • 495.799
 
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Names and Synonyms

Synonyms

  • 1-Phenyl-2-morpholinomethyl-3-ethoxycarbonyl-5-hydroxy-6-bromoindole hydrochloride
  • 6-Bromo-5-hydroxy-2-(morpholinomethyl)-1-phenylindole-3-carboxylic acid ethyl ester HCl

Systematic Name

  • Indole-3-carboxylic acid, 6-bromo-5-hydroxy-2-(morpholinomethyl)-1-phenyl-, ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 88461-88-5

System Generated Number

  • 0088461885

Molecular Formulas

Molecular Formula

  • C22-H23-Br-N2-O4.Cl-H

Molecular Formula Fragments

  • C22-H23-Br-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H23BrN2O4.ClH/c1-2-29-22(27)21-16-12-20(26)17(23)13-18(16)25(15-6-4-3-5-7-15)19(21)14-24-8-10-28-11-9-24;/h3-7,12-13,26H,2,8-11,14H2,1H3;1H

InChIKey

SOSYXINOWQRFOZ-UHFFFAOYSA-N

Smiles

c1(n(c2cc(Br)c(cc2c1C(OCC)=O)O)c1ccccc1)C[NH+]1CCOCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD16 oral 1gm/kg (1000mg/kg)   Russian Pharmacology and Toxicology Vol. 46, Pg. 223, 1983.