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Substance Name: 2H-Benz(e)isoindoline, 3a,4,5,9b-tetrahydro-, hydrochloride, (Z)-
RN: 54915-14-9
InChIKey: QKHCZIPTANSJQT-UHFFFAOYSA-N

Molecular Formula

  • C12-H15-N.Cl-H

Molecular Weight

  • 209.718
 
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Names and Synonyms

Synonym

  • cis-3a,4,5,9b-Tetrahydrobenzo(e)isoindoline hydrochloride

Systematic Name

  • 2H-Benz(e)isoindoline, 3a,4,5,9b-tetrahydro-, hydrochloride, (Z)-

Registry Numbers

CAS Registry Number

  • 54915-14-9

System Generated Number

  • 0054915149

Molecular Formulas

Molecular Formula

  • C12-H15-N.Cl-H

Molecular Formula Fragments

  • C12-H15-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H15N.ClH/c1-2-4-11-9(3-1)5-6-10-7-13-8-12(10)11;/h1,3,5-6,10,12-13H,2,4,7-8H2;1H

InChIKey

QKHCZIPTANSJQT-UHFFFAOYSA-N

Smiles

C12=C(C=C[C@@H]3[C@@H]1CNC3)C=CCC2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 206, 1975.