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Substance Name: Isoquino(2,1-d)(1,4)benzodiazepin-6(7H)-one, 5,9,10,14b-tetrahydro-5-methyl-2-nitro-
RN: 19007-22-8
InChIKey: CJHSAPCTKCAXDL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-N3-O3

Molecular Weight

  • 323.3503
 
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Names and Synonyms

Synonyms

  • 5,9,10,14b-Tetrahydro-5-methyl-2-nitroisoquino(2,1-d)(1,4)benzodiazepin-6(7H)-one
  • BRN 0765371

Systematic Name

  • Isoquino(2,1-d)(1,4)benzodiazepin-6(7H)-one, 5,9,10,14b-tetrahydro-5-methyl-2-nitro-

Registry Numbers

CAS Registry Number

  • 19007-22-8

System Generated Number

  • 0019007228

Structure Descriptors

InChI

1S/C18H17N3O3/c1-19-16-7-6-13(21(23)24)10-15(16)18-14-5-3-2-4-12(14)8-9-20(18)11-17(19)22/h2-7,10,18H,8-9,11H2,1H3

InChIKey

CJHSAPCTKCAXDL-UHFFFAOYSA-N

Smiles

CN1C(=O)CN2CCc3ccccc3C2c4cc(ccc14)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 777, 1968.