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Substance Name: Morpholine, 4-(4-(5H-dibenzo(a,d)cyclohepten-5-ylidene)-2-butynyl)-, ethanedioate (1:1)
RN: 27552-61-0
InChIKey: HBSCJXHDBLWHQQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H21-N-O.C2-H2-O4

Molecular Weight

  • 417.459
 
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Names and Synonyms

Synonyms

  • 4-(4-(5H-Dibenzo(a,d)cyclohepten-5-ylidene)-2-butynyl)morpholine ethanedioate (1:1)
  • 4-(4-(5H-Dibenzo(a,d)cyclohepten-5-ylidene)-2-butynyl)morpholine oxalate
  • AU 2173

Systematic Name

  • Morpholine, 4-(4-(5H-dibenzo(a,d)cyclohepten-5-ylidene)-2-butynyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 27552-61-0

System Generated Number

  • 0027552610

Molecular Formulas

Molecular Formula

  • C23-H21-N-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C23-H21-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C23H21NO.C2H2O4/c1-3-9-21-19(7-1)12-13-20-8-2-4-10-22(20)23(21)11-5-6-14-24-15-17-25-18-16-24;3-1(4)2(5)6/h1-4,7-13H,14-18H2;(H,3,4)(H,5,6)

InChIKey

HBSCJXHDBLWHQQ-UHFFFAOYSA-N

Smiles

C1CN(CC#C\C=C2\c3c(C=Cc4c2cccc4)cccc3)CCO1.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 222mg/kg (222mg/kg)   French Demande Patent Document. Vol. #2005201,
mouse LD50 oral 2600mg/kg (2600mg/kg)   French Demande Patent Document. Vol. #2005201,