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Substance Name: (1,2,4)Triazino(6,1-a)isoquinolin-5-ium, 1,2-dihydro-1-(4-chlorophenyl)-1-hydroxy-, chloride
RN: 97110-09-3
InChIKey: OONGOGLXVNOQSJ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H13-Cl-N3-O.Cl

Molecular Weight

  • 346.2157
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-1-(4-chlorophenyl)-1-hydroxy-(1,2,4)triazino(6,1-a)isoquinolin-5-ium chloride
  • 1-(4-Chlorophenyl)-1-hydroxy-1,2-dihydro-as-triazino(6,1-a)isoquinolin-5-ium chloride

Systematic Name

  • (1,2,4)Triazino(6,1-a)isoquinolin-5-ium, 1,2-dihydro-1-(4-chlorophenyl)-1-hydroxy-, chloride

Registry Numbers

CAS Registry Number

  • 97110-09-3

System Generated Number

  • 0097110093

Molecular Formulas

Molecular Formula

  • C17-H13-Cl-N3-O.Cl

Molecular Formula Fragments

  • C17-H13-Cl-N3-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C17H13ClN3O.ClH/c18-14-7-5-13(6-8-14)17(22)16-15-4-2-1-3-12(15)9-10-21(16)20-11-19-17;/h1-11,16,22H;1H/q+1;/p-1

InChIKey

OONGOGLXVNOQSJ-UHFFFAOYSA-M

Smiles

c1ccc2c(c1)C=C[N+]3=NC=NC(C23)(c4ccc(cc4)Cl)O.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 560mg/kg (560mg/kg)   United States Patent Document. Vol. #4602018,
rat LD50 oral 1100mg/kg (1100mg/kg)   United States Patent Document. Vol. #4602018,