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Substance Name: Piperidine, 1-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-
RN: 76691-33-3
InChIKey: OLBKOFYAZVZSOY-VAWYXSNFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H18-N2-O3

Molecular Weight

  • 274.318
 
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Names and Synonyms

Synonyms

  • 1-(2-Methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)piperidine
  • BRN 4476800

Systematic Name

  • Piperidine, 1-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-

Registry Numbers

CAS Registry Number

  • 76691-33-3

System Generated Number

  • 0076691333

Structure Descriptors

InChI

1S/C15H18N2O3/c1-12(15(18)16-9-3-2-4-10-16)11-13-5-7-14(8-6-13)17(19)20/h5-8,11H,2-4,9-10H2,1H3/b12-11+

InChIKey

OLBKOFYAZVZSOY-VAWYXSNFSA-N

Smiles

[N+](c1ccc(\C=C(\C(N2CCCCC2)=O)C)cc1)([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 19, Pg. 695, 1980.