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(3aR,6S,7aR)-7a-氯-2-[(4-硝基苯基)磺酰基]-1,2,3,6,7,7a-六氢-3a,6-环氧异吲哚

(3aR,6S,7aR)-7a-Chloro-2-[(4-nitro-phen-yl)sulfon-yl]-1,2,3,6,7,7a-hexa-hydro-3a,6-ep-oxy-iso-indole.

作者信息

Temel Ersin, Demircan Aydın, Kandemir Muhammet Kasım, Colak Medine, Büyükgüngör Orhan

机构信息

Ondokuz Mayıs University, Arts and Sciences Faculty, Department of Physics, TR-55139 Samsun, Turkey.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Sep 18;69(Pt 10):o1551-2. doi: 10.1107/S1600536813025336. eCollection 2013.

DOI:10.1107/S1600536813025336
PMID:24098235
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3790416/
Abstract

In the title compound, C14H13ClN2O5S, the chlorine-substituted tetrahydrofuran ring adopts a twist conformation and the other tetra-hydro-furan ring an envelope conformation with the O atom as the flap. The pyrrolidine ring adopts a twist conformation. In the crystal, C-H⋯O hydrogen bonds link the mol-ecules into zigzag chains running along the b-axis direction.

摘要

在标题化合物C₁₄H₁₃ClN₂O₅S中，氯取代的四氢呋喃环呈扭曲构象，另一个四氢呋喃环呈信封式构象，以O原子为瓣。吡咯烷环呈扭曲构象。在晶体中，C—H⋯O氢键将分子连接成沿b轴方向延伸的锯齿链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/58e44362d421/e-69-o1551-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/3f6efa05fbea/e-69-o1551-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/27da1d5d9499/e-69-o1551-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/58e44362d421/e-69-o1551-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/3f6efa05fbea/e-69-o1551-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/27da1d5d9499/e-69-o1551-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0553/3790416/58e44362d421/e-69-o1551-fig3.jpg

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4
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Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
5
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6
An atom-economical approach to conformationally constrained tricyclic nitrogen heterocycles via sequential and tandem Ugi/intramolecular Diels-Alder reaction of pyrrole.通过吡咯的顺序和串联乌吉/分子内狄尔斯-阿尔德反应构建构象受限三环氮杂环的原子经济方法。
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7
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J Org Chem. 2003 Sep 19;68(19):7193-203. doi: 10.1021/jo0348322.
8
Several convenient methods for the synthesis of 2-amido substituted furans.几种合成2-酰胺基取代呋喃的简便方法。
J Org Chem. 2003 Apr 4;68(7):2609-17. doi: 10.1021/jo026757l.
9
Tandem Dielsminus signAlder Cycloadditions in Organic Synthesis.有机合成中的串联狄尔斯-阿尔德环加成反应。
Chem Rev. 1996 Feb 1;96(1):167-176. doi: 10.1021/cr950029z.