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(+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER

Compound with spectra: 3 NMR

(+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER
SpectraBase Compound ID KGZ9KK1TD3a
InChI InChI=1S/C21H29Cl2N3O2/c1-3-20(27)25-10-11-26(19(14-25)15(2)24-8-4-5-9-24)21(28)13-16-6-7-17(22)18(23)12-16/h6-7,12,15,19H,3-5,8-11,13-14H2,1-2H3/t15-,19-/m0/s1
InChIKey MTYYYARFZLUVMG-KXBFYZLASA-N
Mol Weight 426.39 g/mol
Molecular Formula C21H29Cl2N3O2
Exact Mass 425.163683 g/mol
Enantiomer InChIKey MTYYYARFZLUVMG-DNVCBOLYSA-N

View Spectrum of (+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2

View Spectrum of (+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2

View Spectrum of (+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2
  • (+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MINOR-ROTAMER
  • (+)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE
(-)-1-[(R)-4-[2-(3,4-DICHLOROPHENYL)-ACETYL]-3-[(R)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-PROPAN-1-ONE;MAJOR-ROTAMER
U-69,593
5-Chloro-2-iodo-N-methyl-N-((1S,6S)-6-pyrrolidin-1-yl-cyclohex-2-enyl)-benzamide
2-(1,3-benzodioxol-5-yl)-N-3-fluorophenyl-N-[1-(1-phenylethyl)piperidin-4-yl]acetamide
(E)-2-[N-ALLYL-2-PHENYL-2-(2-PHENYLHYDRAZONO)-ACETAMIDO)-N-CYCLOHEXYL-4-METHYLPENTANAMIDE;ROTAMER-A
3,6-DIOXO-N,N',1,4-TETRABENZYL-2,5-PIPERAZINEDIACETAMIDE
Majusculamide B
(8R,8aS)-8-hydroxy-8-phenyl-3,6,7,8a-tetrahydroindolizin-5-one
(2R,5aR,7R,10aS)-2,7-Di(butoxy)octahydrodipyrrolo[1,2-a:1',2'-d]pyrazine-5,10-dione
(-)-Benzyl 2.alpha.-ethyl-4-oxo-3,10-adizabicyclo[4.3.1]decane-10-carboxylate
Title Journal or Book Year
Methylated Analogues of Methyl (R)-4-(3,4-Dichlorophenylacetyl)- 3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate (GR-89,696) as Highly Potent κ-Receptor Agonists:  Stereoselective Synthesis, Opioid-Receptor Affinity, Receptor Selectivity, and Functional Studies Journal of Medicinal Chemistry 2001
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