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Substance Name: Propanamide, N-(2-(4-butyl-1-piperazinyl)-1-methylethyl)-N-phenyl-, ethanedioate (1:2)
RN: 77562-98-2
InChIKey: IJYYCKKGGLOVBZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H33-N3-O.2C2-H2-O4

Molecular Weight

  • 511.5683
 
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Names and Synonyms

Synonym

  • N-(1-Methyl-2-(4-n-butylpiperazino)ethyl)propionanilide dioxalate

Systematic Name

  • Propanamide, N-(2-(4-butyl-1-piperazinyl)-1-methylethyl)-N-phenyl-, ethanedioate (1:2)

Registry Numbers

CAS Registry Number

  • 77562-98-2

System Generated Number

  • 0077562982

Molecular Formulas

Molecular Formula

  • C20-H33-N3-O.2C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C20-H33-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C20H33N3O.2C2H2O4/c1-4-6-12-21-13-15-22(16-14-21)17-18(3)23(20(24)5-2)19-10-8-7-9-11-19;2*3-1(4)2(5)6/h7-11,18H,4-6,12-17H2,1-3H3;2*(H,3,4)(H,5,6)

InChIKey

IJYYCKKGGLOVBZ-UHFFFAOYSA-N

Smiles

CCCCN1CCN(CC1)CC(C)N(c2ccccc2)C(=O)CC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD subcutaneous > 100mg/kg (100mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE
Chemical and Pharmaceutical Bulletin. Vol. 28, Pg. 3315, 1980.