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Substance Name: Benzeneethanamine, alpha-methyl-N-(1-methyl-4-phenyl-2-pyrrolidinylidene)-, (E)-2-butenedioate (1:1)
RN: 94221-65-5
InChIKey: PQOGNLJHZYZIBA-IGNLTOFWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2.C4-H4-O4

Molecular Weight

  • 408.4952
 
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Names and Synonyms

Synonym

  • 1-Methyl-4-phenyl-2-phenylisopropyliminopyrrolidine hydrogen fumarate

Systematic Name

  • Benzeneethanamine, alpha-methyl-N-(1-methyl-4-phenyl-2-pyrrolidinylidene)-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 94221-65-5

System Generated Number

  • 0094221655

Molecular Formulas

Molecular Formula

  • C20-H24-N2.C4-H4-O4

Molecular Formula Fragments

  • C20-H24-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22N2.C5H6O4/c1-21-15-18(17-10-6-3-7-11-17)14-19(21)20-13-12-16-8-4-2-5-9-16;1-3(5(8)9)2-4(6)7/h2-11,18H,12-15H2,1H3;2H,1H3,(H,6,7)(H,8,9)/b20-19+;3-2+

InChIKey

PQOGNLJHZYZIBA-IGNLTOFWSA-N

Smiles

C1(=N\CCc2ccccc2)/N(CC(C1)c1ccccc1)C.C(=C\C(=O)O)(/C(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4556674,
mouse LDLo oral 200mg/kg (200mg/kg)   United States Patent Document. Vol. #4556674,