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Substance Name: 1,4-Ethano-1H-pyrido(3,2-b)(1,5)benzodiazepine, 2,3,4,4a,5,10,11,11a-octahydro-5,10-diacetyl-
RN: 72031-20-0
InChIKey: PSMSESDSYNREIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N3-O2

Molecular Weight

  • 313.3987
 
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Names and Synonyms

Synonyms

  • 2,3,4,4a,5,10,11,11a-Octahydro-5,10-diacetyl-1,4-ethano-1H-pyrido(3,2-b)(1,5)benzodiazepine
  • 5,10-Diacetyl-4a,5,11,11a-tetrahydro-10H-quinuclidino(2,3-c)-1,5-benzodiazepine

Systematic Name

  • 1,4-Ethano-1H-pyrido(3,2-b)(1,5)benzodiazepine, 2,3,4,4a,5,10,11,11a-octahydro-5,10-diacetyl-

Registry Numbers

CAS Registry Number

  • 72031-20-0

System Generated Number

  • 0072031200

Structure Descriptors

InChI

1S/C18H23N3O2/c1-12(22)20-11-17-18(14-7-9-19(17)10-8-14)21(13(2)23)16-6-4-3-5-15(16)20/h3-6,14,17-18H,7-11H2,1-2H3

InChIKey

PSMSESDSYNREIH-UHFFFAOYSA-N

Smiles

CC(=O)N1CC2C(C3CCN2CC3)N(c4c1cccc4)C(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 13, Pg. 819, 1979.