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Substance Name: Benzoic acid, p-(2-methyl-5-phenylpyrrol-1-yl)-
RN: 26180-30-3
InChIKey: HBCZMEBBIJRTOC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-N-O2

Molecular Weight

  • 277.322
 
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Names and Synonyms

Synonym

  • p-(2-Methyl-5-phenylpyrrol-1-yl)benzoic acid

Systematic Name

  • Benzoic acid, p-(2-methyl-5-phenylpyrrol-1-yl)-

Registry Numbers

CAS Registry Number

  • 26180-30-3

System Generated Number

  • 0026180303

Structure Descriptors

InChI

1S/C18H15NO2/c1-13-7-12-17(14-5-3-2-4-6-14)19(13)16-10-8-15(9-11-16)18(20)21/h2-12H,1H3,(H,20,21)

InChIKey

HBCZMEBBIJRTOC-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)n1c(ccc1c1ccccc1)C)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1855mg/kg (1855mg/kg)   French Demande Patent Document. Vol. #2054474,