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Substance Name: 1-Propanamine, 3-((5-(4-chlorophenyl)-1H-pyrazol-3-yl)oxy)-N,N-dimethy-, (Z)-2-butenedioate (1:1)
RN: 86871-43-4
InChIKey: SOUCMKWRSJZNLQ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-Cl-N3-O.C4-H4-O4

Molecular Weight

  • 395.8408
 
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Names and Synonyms

Synonyms

  • 3-p-Chlorophenyl-5-dimethylaminopropoxy-pyrazole maleate
  • p-Chlorophenyl-3 dimethylaminopropoxy-5 pyrazole maleate
  • p-Chlorophenyl-3 dimethylaminopropoxy-5 pyrazole maleate [French]

Systematic Name

  • 1-Propanamine, 3-((5-(4-chlorophenyl)-1H-pyrazol-3-yl)oxy)-N,N-dimethy-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 86871-43-4

System Generated Number

  • 0086871434

Molecular Formulas

Molecular Formula

  • C14-H18-Cl-N3-O.C4-H4-O4

Molecular Formula Fragments

  • C14-H18-Cl-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18ClN3O.C4H4O4/c1-18(2)8-3-9-19-14-10-13(16-17-14)11-4-6-12(15)7-5-11;5-3(6)1-2-4(7)8/h4-7,10H,3,8-9H2,1-2H3,(H,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

SOUCMKWRSJZNLQ-WLHGVMLRSA-N

Smiles

CN(C)CCCOc1cc([nH]n1)c2ccc(cc2)Cl.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   European Patent Application. Vol. #0076756,
mouse LD50 oral 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0076756,