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Substance Name: 1-Piperazineethanol, 4-(4-chlorophenyl)-alpha-((3-nitrophenoxy)methyl)-
RN: 64511-52-0
InChIKey: FYYVQWMPEMAZIW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-Cl-N3-O4

Molecular Weight

  • 391.8528
 
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Names and Synonyms

Synonyms

  • 4-(4-Chlorophenyl)-alpha-((3-nitrophenoxy)methyl)-1-piperazineethanol
  • 5-23-02-00122 (Beilstein Handbook Reference)
  • BRN 0584565

Systematic Name

  • 1-Piperazineethanol, 4-(4-chlorophenyl)-alpha-((3-nitrophenoxy)methyl)-

Registry Numbers

CAS Registry Number

  • 64511-52-0

System Generated Number

  • 0064511520

Structure Descriptors

InChI

1S/C19H22ClN3O4/c20-15-4-6-16(7-5-15)22-10-8-21(9-11-22)13-18(24)14-27-19-3-1-2-17(12-19)23(25)26/h1-7,12,18,24H,8-11,13-14H2

InChIKey

FYYVQWMPEMAZIW-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)OCC(CN2CCN(CC2)c3ccc(cc3)Cl)O)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 15, Pg. 466, 1977.