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Substance Name: 1H-1,3-Diazepine-4-carboxylic acid, hexahydro-2-(nitroimino)-, methyl ester, (+)-
RN: 28958-87-4
InChIKey: WNOKAAKCULHZPY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-N4-O4

Molecular Weight

  • 216.196
 
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Names and Synonyms

Synonyms

  • Methyl (+)-hexahydro-2-(nitroimino)-1H-1,3-diazepine-4-carboxylate
  • OH-47

Systematic Name

  • 1H-1,3-Diazepine-4-carboxylic acid, hexahydro-2-(nitroimino)-, methyl ester, (+)-

Registry Numbers

CAS Registry Number

  • 28958-87-4

System Generated Number

  • 0028958874

Structure Descriptors

InChI

1S/C7H12N4O4/c1-15-6(12)5-3-2-4-8-7(9-5)10-11(13)14/h5H,2-4H2,1H3,(H2,8,9,10)

InChIKey

WNOKAAKCULHZPY-UHFFFAOYSA-N

Smiles

N1\C(N[C@@H](CCC1)C(=O)OC)=N\[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 300mg/kg (300mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 185, Pg. 159, 1970.