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Substance Name: Decanamide, N-(3-nitro-4-(2-pyridinylmethyl)phenyl)-
RN: 63233-55-6
InChIKey: KHXPDEAOWXJGLT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O3

Molecular Weight

  • 383.4891
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 63233-55-6

System Generated Number

  • 0063233556

Structure Descriptors

InChI

1S/C22H29N3O3/c1-2-3-4-5-6-7-8-12-22(26)24-20-14-13-18(21(17-20)25(27)28)16-19-11-9-10-15-23-19/h9-11,13-15,17H,2-8,12,16H2,1H3,(H,24,26)

InChIKey

KHXPDEAOWXJGLT-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4851414,
rat LD50 oral > 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4851414,