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Substance Name: Pentanamide, N-(3-nitro-4-(2-pyridinylmethyl)phenyl)-
RN: 123947-03-5
InChIKey: GPACCUWDMXPHBM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N3-O3

Molecular Weight

  • 313.3551
 
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Names and Synonyms

Synonyms

  • alpha-(p-Valerylamino-o-nitrobenzyl)pyridine
  • N-(3-Nitro-4-(2-pyridinylmethyl)phenyl)pentanamide

Systematic Name

  • Pentanamide, N-(3-nitro-4-(2-pyridinylmethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 123947-03-5

System Generated Number

  • 0123947035

Structure Descriptors

InChI

1S/C17H19N3O3/c1-2-3-7-17(21)19-15-9-8-13(16(12-15)20(22)23)11-14-6-4-5-10-18-14/h4-6,8-10,12H,2-3,7,11H2,1H3,(H,19,21)

InChIKey

GPACCUWDMXPHBM-UHFFFAOYSA-N

Smiles

CCCCC(=O)Nc1ccc(c(c1)[N+](=O)[O-])Cc2ccccn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #4851414,