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Substance Name: 5H-Isoquino(2,1-d)(1,4)benzodiazepin-8-ium, 6,7,9,10-tetrahydro-12,13-dimethoxy-7-methyl-6-oxo-, bromide
RN: 54971-35-6
InChIKey: BVWNPZVOXXZLEM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N2-O3.Br

Molecular Weight

  • 417.3009
 
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Names and Synonyms

  • 5H-Isoquino(2,1-d)(1,4)benzodiazepin-8-ium, 6,7,9,10-tetrahydro-12,13-dimethoxy-7-methyl-6-oxo-, bromide

Registry Numbers

CAS Registry Number

  • 54971-35-6

System Generated Number

  • 0054971356

Molecular Formulas

Molecular Formula

  • C20-H21-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C20-H21-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C20H20N2O3.BrH/c1-12-20(23)21-16-7-5-4-6-14(16)19-15-11-18(25-3)17(24-2)10-13(15)8-9-22(12)19;/h4-7,10-12H,8-9H2,1-3H3;1H

InChIKey

BVWNPZVOXXZLEM-UHFFFAOYSA-N

Smiles

CC1C(=O)Nc2ccccc2C3=[N+]1CCc4c3cc(c(c4)OC)OC.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Farmaco, Edizione Scientifica. Vol. 37, Pg. 555, 1982.