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Substance Name: Ici 204448
RN: 121264-04-8
InChIKey: FNDGLVOYAQNQPE-UHFFFAOYSA-N

Note

  • Kappa opioid receptor agonist.

Molecular Formula

  • C23-H26-Cl2-N2-O4.Cl-H

Molecular Weight

  • 501.835
 
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Names and Synonyms

Name of Substance

  • Ici 204448

Synonyms

  • Ici-204448
  • N(1)-(2-(N-Methyl-3,4-dichlorophenylacetamido)-2-(3-carboxyphenyl)ethyl)pyrrolidine

Systematic Name

  • Acetic acid, (3-(1-(((3,4-dichlorophenyl)acetyl)methylamino)-2-(1-pyrrolidinyl)ethyl)phenoxy)-, monohydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 121264-04-8

System Generated Number

  • 0121264048

Molecular Formulas

Molecular Formula

  • C23-H26-Cl2-N2-O4.Cl-H

Molecular Formula Fragments

  • C23-H26-Cl2-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H26Cl2N2O4.ClH/c1-26(22(28)12-16-7-8-19(24)20(25)11-16)21(14-27-9-2-3-10-27)17-5-4-6-18(13-17)31-15-23(29)30;/h4-8,11,13,21H,2-3,9-10,12,14-15H2,1H3,(H,29,30);1H

InChIKey

FNDGLVOYAQNQPE-UHFFFAOYSA-N

Smiles

C(COc1cc(ccc1)[C@@H](CN1CCCC1)N(C)C(=O)Cc1cc(c(cc1)Cl)Cl)(=O)O.Cl