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Substance Name: 1H-Indole-2-carboxylic acid, 3-((2-chlorophenyl)methyl)-1-methyl-
RN: 57055-64-8
InChIKey: MNZNKUBUMFBFRO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-Cl-N-O2

Molecular Weight

  • 299.756
 
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Names and Synonyms

Synonyms

  • 1-Methyl-2-carboxy-3-(o-chlorobenzyl)indole
  • 3-((2-Chlorophenyl)methyl)-1-methyl-1H-indole-2-carboxylic acid
  • 5-22-03-00451 (Beilstein Handbook Reference)
  • BRN 0488698

Systematic Name

  • 1H-Indole-2-carboxylic acid, 3-((2-chlorophenyl)methyl)-1-methyl-

Registry Numbers

CAS Registry Number

  • 57055-64-8

System Generated Number

  • 0057055648

Structure Descriptors

InChI

1S/C17H14ClNO2/c1-19-15-9-5-3-7-12(15)13(16(19)17(20)21)10-11-6-2-4-8-14(11)18/h2-9H,10H2,1H3,(H,20,21)

InChIKey

MNZNKUBUMFBFRO-UHFFFAOYSA-N

Smiles

c1(c2c(cccc2)n(c1C(O)=O)C)Cc1c(cccc1)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 885, 1976.