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Substance Name: Pyrrolidine, 1-(6,7-dihydro-5H-benzocyclohepten-7-yl)-, (E)-2-butenedioate (2:1)
RN: 62819-73-2
InChIKey: LYDKVLKCJSOKSS-WXXKFALUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H38-N2.C4-H4-O4

Molecular Weight

  • 542.7158
 
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Names and Synonyms

Synonyms

  • 1-(6,7-Dihydro-5H-benzocyclohepten-7-yl)pyrrolidine (E)-2-butenedioate (2:1)
  • Di-(7-pyrrolidin-1-yl) 6,7-dihydro-5H-benzocycloheptene fumarate
  • Di-(7-pyrrolidin-1-yl) 6,7-dihydro-5H-benzocycloheptene fumarate [French]

Systematic Name

  • Pyrrolidine, 1-(6,7-dihydro-5H-benzocyclohepten-7-yl)-, (E)-2-butenedioate (2:1)

Registry Numbers

CAS Registry Number

  • 62819-73-2

System Generated Number

  • 0062819732

Molecular Formulas

Molecular Formula

  • C30-H38-N2.C4-H4-O4

Molecular Formula Fragments

  • C30-H38-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/2C15H19N.C4H4O4/c2*1-2-6-14-8-10-15(9-7-13(14)5-1)16-11-3-4-12-16;5-3(6)1-2-4(7)8/h2*1-2,5-7,9,15H,3-4,8,10-12H2;1-2H,(H,5,6)(H,7,8)/b;;2-1+

InChIKey

LYDKVLKCJSOKSS-WXXKFALUSA-N

Smiles

c1ccc2c(c1)CCC(C=C2)N3CCCC3.c1ccc2c(c1)CCC(C=C2)N3CCCC3.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   French Demande Patent Document. Vol. #2359608,