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Substance Name: 1-Piperazinepropionic acid, 4-(2-(9-fluorenyloxy)ethyl)-, dimaleate
RN: 72461-61-1
InChIKey: QKJFKZUZCKMRNQ-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N2-O3.2C4-H4-O4

Molecular Weight

  • 598.6016
 
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Names and Synonyms

Synonyms

  • 1-Piperazinepropanoic acid, 4-(2-(9H-fluoren-9-yloxy)ethyl)-, (Z)-2-butenedioate (1:2)
  • 4-(2-(9-Fluorenyloxy)ethyl)-1-piperazinepropionic acid dimaleate

Systematic Name

  • 1-Piperazinepropionic acid, 4-(2-(9-fluorenyloxy)ethyl)-, dimaleate

Registry Numbers

CAS Registry Number

  • 72461-61-1

System Generated Number

  • 0072461611

Molecular Formulas

Molecular Formula

  • C22-H26-N2-O3.2C4-H4-O4

Molecular Formula Fragments

  • C22-H26-N2-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H26N2O3.2C4H4O4/c25-21(26)9-10-23-11-13-24(14-12-23)15-16-27-22-19-7-3-1-5-17(19)18-6-2-4-8-20(18)22;2*5-3(6)1-2-4(7)8/h1-8,22H,9-16H2,(H,25,26);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

QKJFKZUZCKMRNQ-LVEZLNDCSA-N

Smiles

c1cc-2c(cc1)C(c3c2cccc3)OCCN4CCN(CC4)CCC(=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 oral 1377mg/kg (1377mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 149, 1980.