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Substance Name: Ethanamine, N-(4-(2-benzofuranyl)-1-methyl-2-pyrrolidinylidene)-2-methoxy-, (E)-2-butenedioate (1:1)
RN: 94221-88-2
InChIKey: JAPBPDOLJJFUJB-HORXMJMVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-N2-O2.C4-H4-O4

Molecular Weight

  • 388.4176
 
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Names and Synonyms

Synonym

  • 1-Methyl-4-(2-benzofuryl)-2-(2-methoxyethylimino)pyrrolidine hydrogen fumarate

Systematic Name

  • Ethanamine, N-(4-(2-benzofuranyl)-1-methyl-2-pyrrolidinylidene)-2-methoxy-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 94221-88-2

System Generated Number

  • 0094221882

Molecular Formulas

Molecular Formula

  • C16-H20-N2-O2.C4-H4-O4

Molecular Formula Fragments

  • C16-H20-N2-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H20N2O2.C4H4O4/c1-18-11-13(10-16(18)17-7-8-19-2)15-9-12-5-3-4-6-14(12)20-15;5-3(6)1-2-4(7)8/h3-6,9,13H,7-8,10-11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b17-16+;2-1+

InChIKey

JAPBPDOLJJFUJB-HORXMJMVSA-N

Smiles

c1(oc2c(c1)cccc2)C1CN(C(=N\CCOC)\C1)C.C(=O)(/C=C/C(=O)O)O

Toxicity

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