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Substance Name: 5H-Dibenz(b,f)azepine, 5-((4-methyl-1-piperazinyl)acetyl)-, (Z)-2-butenedioate (1:2)
RN: 118989-87-0
InChIKey: MTYJIIFMSSUMKW-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N3-O.2C4-H4-O4

Molecular Weight

  • 565.5759
 
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Names and Synonyms

Synonym

  • 5-(2-(4-Methyl-1-piperazinyl)acetyl)-5H-dibenz(b,f)azepine bis(hydrogen maleate)

Systematic Name

  • 5H-Dibenz(b,f)azepine, 5-((4-methyl-1-piperazinyl)acetyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 118989-87-0

System Generated Number

  • 0118989870

Molecular Formulas

Molecular Formula

  • C21-H23-N3-O.2C4-H4-O4

Molecular Formula Fragments

  • C21-H23-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23N3O.2C4H4O4/c1-22-12-14-23(15-13-22)16-21(25)24-19-8-4-2-6-17(19)10-11-18-7-3-5-9-20(18)24;2*5-3(6)1-2-4(7)8/h2-11H,12-16H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

MTYJIIFMSSUMKW-LVEZLNDCSA-N

Smiles

CN1CCN(CC1)CC(=O)N2c3c(cccc3)C=Cc4c2cccc4.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1574mg/kg (1574mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 1820, 1988.