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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-10-benzoyl-
RN: 72031-22-2
InChIKey: OPWYHABVMQCCBC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N3-O

Molecular Weight

  • 333.4327
 
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Names and Synonyms

Synonyms

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

Registry Numbers

CAS Registry Number

  • 72031-22-2

System Generated Number

  • 0072031222

Structure Descriptors

InChI

1S/C21H23N3O/c25-21(16-6-2-1-3-7-16)24-14-19-20(15-10-12-23(19)13-11-15)22-17-8-4-5-9-18(17)24/h1-9,15,19-20,22H,10-14H2

InChIKey

OPWYHABVMQCCBC-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)N2CC3C(C4CCN3CC4)Nc5c2cccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 310mg/kg (310mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 13(8), Pg. 45, 1979.