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Substance Name: 3-Buten-2-one, 1,1-diphenyl-4-(1-pyrrolidinyl)-, hydrochloride
RN: 100482-65-3
InChIKey: TYRFTFDMBTXXKL-ZUQRMPMESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N-O.Cl-H

Molecular Weight

  • 327.853
 
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Names and Synonyms

Synonym

  • 1,1-Diphenyl-4-(1-pyrrolidinyl)-3-buten-2-one hydrochloride

Systematic Name

  • 3-Buten-2-one, 1,1-diphenyl-4-(1-pyrrolidinyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 100482-65-3

System Generated Number

  • 0100482653

Molecular Formulas

Molecular Formula

  • C20-H21-N-O.Cl-H

Molecular Formula Fragments

  • C20-H21-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21NO.ClH/c22-19(13-16-21-14-7-8-15-21)20(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h1-6,9-13,16,20H,7-8,14-15H2;1H/b16-13+;

InChIKey

TYRFTFDMBTXXKL-ZUQRMPMESA-N

Smiles

C(c1ccccc1)(c1ccccc1)C(\C=C\[N+]1CCCC1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 30mg/kg (30mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

PERIPHERAL NERVE AND SENSATION: LOCAL ANESTHETIC
Chimica Therapeutica. Vol. 1, Pg. 35, 1965.