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Substance Name: Benzeneethanamine, N-(1-methyl-4-phenyl-2-pyrrolidinylidene)-, (E)-2-butenedioate (1:1)
RN: 94221-63-3
InChIKey: RFBVVWJHUCXDGD-SJWORKMSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2.C4-H4-O4

Molecular Weight

  • 394.4684
 
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Names and Synonyms

Synonyms

  • 1-Methyl-4-phenyl-2-phenylethyliminopyrrolidine hydrogen fumarate
  • N-(1-Methyl-4-phenyl-2-pyrrolidinylidene)benzeneethanamine (E)-2-butenedioate (1:1)

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 94221-63-3

System Generated Number

  • 0094221633

Molecular Formulas

Molecular Formula

  • C19-H22-N2.C4-H4-O4

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C19H22N2.C4H4O4/c1-21-15-18(17-10-6-3-7-11-17)14-19(21)20-13-12-16-8-4-2-5-9-16;5-3(6)1-2-4(7)8/h2-11,18H,12-15H2,1H3;1-2H,(H,5,6)(H,7,8)/b20-19+;2-1+

InChIKey

RFBVVWJHUCXDGD-SJWORKMSSA-N

Smiles

C1(=N\CCc2ccccc2)/N(CC(C1)c1ccccc1)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,