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Substance Name: 4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(4-morpholinyl)-2-butynyl)-, monohydrochloride
RN: 39488-12-5
InChIKey: PLXWGCXAVSGEDQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-N2-O3.Cl-H

Molecular Weight

  • 336.8169
 
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Names and Synonyms

Synonym

  • 3a,4,7,7a-Tetrahydro-2-(4-(4-morpholinyl)-2-butynyl)-4,7-methano-1H-isoindole-1,3-dione HCl

Systematic Name

  • 4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(4-morpholinyl)-2-butynyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 39488-12-5

System Generated Number

  • 0039488125

Molecular Formulas

Molecular Formula

  • C17-H20-N2-O3.Cl-H

Molecular Formula Fragments

  • C17-H20-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H20N2O3.ClH/c20-16-14-12-3-4-13(11-12)15(14)17(21)19(16)6-2-1-5-18-7-9-22-10-8-18;/h3-4,12-15H,5-11H2;1H

InChIKey

PLXWGCXAVSGEDQ-UHFFFAOYSA-N

Smiles

C1COCCN1CC#CCN2C(=O)C3C4CC(C3C2=O)C=C4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 106mg/kg (106mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 31, Pg. 401, 1974.