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Substance Name: Piperazine, 1-((4-chlorophenyl)methyl)-4-((6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methyl)-, (Z)-2-butenedioate (1:2)
RN: 55037-73-5
InChIKey: HMWNOFWKGIENAY-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-Cl-N2.2C4-H4-O4

Molecular Weight

  • 601.0923
 
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Names and Synonyms

  • Piperazine, 1-((4-chlorophenyl)methyl)-4-((6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 55037-73-5

System Generated Number

  • 0055037735

Molecular Formulas

Molecular Formula

  • C23-H29-Cl-N2.2C4-H4-O4

Molecular Formula Fragments

  • C23-H29-Cl-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C23H29ClN2.2C4H4O4/c24-23-10-7-19(8-11-23)17-25-12-14-26(15-13-25)18-20-6-9-21-4-2-1-3-5-22(21)16-20;2*5-3(6)1-2-4(7)8/h6-11,16H,1-5,12-15,17-18H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

HMWNOFWKGIENAY-LVEZLNDCSA-N

Smiles

c1c(ccc(c1)Cl)CN2CCN(CC2)Cc3cc4c(cc3)CCCCC4.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 2gm/kg (2000mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Collection of Czechoslovak Chemical Communications. Vol. 39, Pg. 2276, 1974.