(1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate

In the title compound, C(16)H(15)F(3)N(2)O(4), the relative stereochemistry of the four stereogenic C atoms has been determined. The carb­oxy­methyl and 2-(trifluoro­meth­yl)­phenyl substituents of the pyrrolidine cycle have a cis mutual arrangement. The five-membered saturated aza­cycle adopts an e...

Descripción completa

Detalles Bibliográficos
Autores principales: Kudryavtsev, Konstantin V., Ivantcova, Polina M., Churakov, Andrei V.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569227/
https://www.ncbi.nlm.nih.gov/pubmed/23424450
http://dx.doi.org/10.1107/S1600536812051471
_version_ 1782258856662925312
author Kudryavtsev, Konstantin V.
Ivantcova, Polina M.
Churakov, Andrei V.
author_facet Kudryavtsev, Konstantin V.
Ivantcova, Polina M.
Churakov, Andrei V.
author_sort Kudryavtsev, Konstantin V.
collection PubMed
description In the title compound, C(16)H(15)F(3)N(2)O(4), the relative stereochemistry of the four stereogenic C atoms has been determined. The carb­oxy­methyl and 2-(trifluoro­meth­yl)­phenyl substituents of the pyrrolidine cycle have a cis mutual arrangement. The five-membered saturated aza­cycle adopts an envelope conformation with the N atom occupying the flap position. In the crystal, adjacent mol­ecules are combined in centrosymmetric dimers by two weak N—H⋯O hydrogen bonds.
format Online
Article
Text
id pubmed-3569227
institution National Center for Biotechnology Information
language English
publishDate 2013
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-35692272013-02-19 (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate Kudryavtsev, Konstantin V. Ivantcova, Polina M. Churakov, Andrei V. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(15)F(3)N(2)O(4), the relative stereochemistry of the four stereogenic C atoms has been determined. The carb­oxy­methyl and 2-(trifluoro­meth­yl)­phenyl substituents of the pyrrolidine cycle have a cis mutual arrangement. The five-membered saturated aza­cycle adopts an envelope conformation with the N atom occupying the flap position. In the crystal, adjacent mol­ecules are combined in centrosymmetric dimers by two weak N—H⋯O hydrogen bonds. International Union of Crystallography 2013-01-04 /pmc/articles/PMC3569227/ /pubmed/23424450 http://dx.doi.org/10.1107/S1600536812051471 Text en © Kudryavtsev et al. 2013 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Kudryavtsev, Konstantin V.
Ivantcova, Polina M.
Churakov, Andrei V.
(1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title_full (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title_fullStr (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title_full_unstemmed (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title_short (1SR,3RS,3aSR,6aRS)-Methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
title_sort (1sr,3rs,3asr,6ars)-methyl 5-methyl-4,6-dioxo-3-[2-(trifluoro­meth­yl)phen­yl]octa­hydro­pyrrolo­[3,4-c]pyrrole-1-carboxyl­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569227/
https://www.ncbi.nlm.nih.gov/pubmed/23424450
http://dx.doi.org/10.1107/S1600536812051471
work_keys_str_mv AT kudryavtsevkonstantinv 1sr3rs3asr6arsmethyl5methyl46dioxo32trifluoromethylphenyloctahydropyrrolo34cpyrrole1carboxylate
AT ivantcovapolinam 1sr3rs3asr6arsmethyl5methyl46dioxo32trifluoromethylphenyloctahydropyrrolo34cpyrrole1carboxylate
AT churakovandreiv 1sr3rs3asr6arsmethyl5methyl46dioxo32trifluoromethylphenyloctahydropyrrolo34cpyrrole1carboxylate

Ejemplares similares