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Substance Name: 1-Piperazinepropanamine, N,N-dimethyl-gamma-phenyl-4-(phenylmethyl)-, (Z)-2-butenedioate (1:3)
RN: 81402-42-8
InChIKey: UYSPKBXYONEUJH-LDFLFNBESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-N3.3C4-H4-O4

Molecular Weight

  • 685.7227
 
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Names and Synonyms

Synonym

  • N,N-Dimethyl-gamma-phenyl-4-(phenylmethyl)-1-piperazinepropanamine maleate (1:3)

Systematic Name

  • 1-Piperazinepropanamine, N,N-dimethyl-gamma-phenyl-4-(phenylmethyl)-, (Z)-2-butenedioate (1:3)

Registry Numbers

CAS Registry Number

  • 81402-42-8

System Generated Number

  • 0081402428

Molecular Formulas

Molecular Formula

  • C22-H31-N3.3C4-H4-O4

Molecular Formula Fragments

  • C22-H31-N3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H31N3.3C4H4O4/c1-23(2)14-13-22(21-11-7-4-8-12-21)25-17-15-24(16-18-25)19-20-9-5-3-6-10-20;3*5-3(6)1-2-4(7)8/h3-12,22H,13-19H2,1-2H3;3*1-2H,(H,5,6)(H,7,8)/b;3*2-1+

InChIKey

UYSPKBXYONEUJH-LDFLFNBESA-N

Smiles

CN(CCC(N1CCN(CC1)Cc2ccccc2)c3ccccc3)C.C(=C/C(=O)O)\C(=O)O.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 intravenous 25mg/kg (25mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 46, Pg. 2729, 1981.