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Substance Name: Butanone, 1-(2-benzoyl-1-pyrrolyl)-4-morpholino-, maleate
RN: 14646-87-8
InChIKey: WBZXBKZFRNMGHF-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2-O2.C4-H4-O4

Molecular Weight

  • 442.465
 
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Names and Synonyms

Synonym

  • 1-(2-Benzoyl-1-pyrrolyl)-4-morpholinobutanone maleate

Systematic Name

  • Butanone, 1-(2-benzoyl-1-pyrrolyl)-4-morpholino-, maleate

Registry Numbers

CAS Registry Number

  • 14646-87-8

System Generated Number

  • 0014646878

Molecular Formulas

Molecular Formula

  • C19-H22-N2-O2.C4-H4-O4

Molecular Formula Fragments

  • C19-H22-N2-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22N2O3.C4H4O4/c22-17(8-10-20-11-13-24-14-12-20)15-21-9-4-7-18(21)19(23)16-5-2-1-3-6-16;5-3(6)1-2-4(7)8/h1-7,9H,8,10-15H2;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

WBZXBKZFRNMGHF-BTJKTKAUSA-N

Smiles

c1(n(ccc1)CC(=O)CC[NH+]1CCOCC1)C(c1ccccc1)=O.C(=C/C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 parenteral 49mg/kg (49mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Chimica Therapeutica. Vol. 1, Pg. 127, 1966.