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Substance Name: 7H-Isoquino(2,1-d)(1,4)benzodiazepin-8-ium, 9,10-dihydro-6-(4-biphenylyl)-3-chloro-12,13-dimethoxy-, bromide
RN: 82802-96-8
InChIKey: FMJSKFOEZPHCAC-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H26-Cl-N2-O2.Br

Molecular Weight

  • 573.9154
 
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Names and Synonyms

  • 7H-Isoquino(2,1-d)(1,4)benzodiazepin-8-ium, 9,10-dihydro-6-(4-biphenylyl)-3-chloro-12,13-dimethoxy-, bromide

Registry Numbers

CAS Registry Number

  • 82802-96-8

System Generated Number

  • 0082802968

Molecular Formulas

Molecular Formula

  • C31-H26-Cl-N2-O2.Br

Molecular Formula Fragments

  • Br
  • C31-H26-Cl-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C31H26ClN2O2.BrH/c1-35-29-16-23-14-15-34-19-28(22-10-8-21(9-11-22)20-6-4-3-5-7-20)33-27-17-24(32)12-13-25(27)31(34)26(23)18-30(29)36-2;/h3-13,16-18H,14-15,19H2,1-2H3;1H/q+1;/p-1

InChIKey

FMJSKFOEZPHCAC-UHFFFAOYSA-M

Smiles

COc1cc2c(cc1OC)C3=[N+](CC2)CC(=Nc4c3ccc(c4)Cl)c5ccc(cc5)c6ccccc6.[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.