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Substance Name: Hippuric acid, p-(2-methyl-5-phenylpyrrol-1-yl)-
RN: 26180-62-1
InChIKey: SCIMPKWPOQVTAW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H18-N2-O3

Molecular Weight

  • 334.373
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 26180-62-1

System Generated Number

  • 0026180621

Structure Descriptors

InChI

1S/C20H18N2O3/c1-14-7-12-18(15-5-3-2-4-6-15)22(14)17-10-8-16(9-11-17)20(25)21-13-19(23)24/h2-12H,13H2,1H3,(H,21,25)(H,23,24)

InChIKey

SCIMPKWPOQVTAW-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1098mg/kg (1098mg/kg)   French Demande Patent Document. Vol. #2054474,