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Substance Name: 1,3-Indandione, 2-phenyl-2-(4-(1-pyrrolidinyl)-2-butynyl)-, hydrochloride
RN: 22019-21-2
InChIKey: YWOUBUAYKPGGMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H21-N-O2.Cl-H

Molecular Weight

  • 379.8848
 
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Names and Synonyms

Synonym

  • 2-Phenyl-2-(delta-pyrrolidinylbutynyl)indan-1,3-dione hydrochloride

Systematic Name

  • 1,3-Indandione, 2-phenyl-2-(4-(1-pyrrolidinyl)-2-butynyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 22019-21-2

System Generated Number

  • 0022019212

Molecular Formulas

Molecular Formula

  • C23-H21-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H21-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H21NO2.ClH/c25-21-19-12-4-5-13-20(19)22(26)23(21,18-10-2-1-3-11-18)14-6-7-15-24-16-8-9-17-24;/h1-5,10-13H,8-9,14-17H2;1H

InChIKey

YWOUBUAYKPGGMN-UHFFFAOYSA-N

Smiles

Cl.O=C1c2ccccc2C(=O)C1(CC#CCN3CCCC3)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 94mg/kg (94mg/kg) BEHAVIORAL: ANTICONVULSANT

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 2, Pg. 428, 1968.