Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate

In the title compound, C(17)H(18)ClNO(5), which was synthesized by reacting 4-chloro-3-formyl­coumarin, acetic acid and tert-butyl isocyanide, the acetamido side chain is convoluted with ring-to-side chain C—C—C—C, C—C—C—N and C—C—N—C torsion angles of −123.30 (14), −135.73 (12) and 176.10 (12)°, re...

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Autores principales: Moriguchi, Tetsuji, Jalli, Venkataprasad, Krishnamurthy, Suvratha, Tsuge, Akihiko, Yoja, Kenji
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719945/
https://www.ncbi.nlm.nih.gov/pubmed/26870464
http://dx.doi.org/10.1107/S2056989015021982
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author Moriguchi, Tetsuji
Jalli, Venkataprasad
Krishnamurthy, Suvratha
Tsuge, Akihiko
Yoja, Kenji
author_facet Moriguchi, Tetsuji
Jalli, Venkataprasad
Krishnamurthy, Suvratha
Tsuge, Akihiko
Yoja, Kenji
author_sort Moriguchi, Tetsuji
collection PubMed
description In the title compound, C(17)H(18)ClNO(5), which was synthesized by reacting 4-chloro-3-formyl­coumarin, acetic acid and tert-butyl isocyanide, the acetamido side chain is convoluted with ring-to-side chain C—C—C—C, C—C—C—N and C—C—N—C torsion angles of −123.30 (14), −135.73 (12) and 176.10 (12)°, respectively. In the crystal, N—H⋯O and weak C—H⋯O hydrogen bonds are present, which together with π–π coumarin-ring inter­actions [ring centroid separations = 3.4582 (8) and 3.6421 (9) Å], give rise to a layered structure lying parallel to (001).
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spelling pubmed-47199452016-02-11 Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate Moriguchi, Tetsuji Jalli, Venkataprasad Krishnamurthy, Suvratha Tsuge, Akihiko Yoja, Kenji Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(17)H(18)ClNO(5), which was synthesized by reacting 4-chloro-3-formyl­coumarin, acetic acid and tert-butyl isocyanide, the acetamido side chain is convoluted with ring-to-side chain C—C—C—C, C—C—C—N and C—C—N—C torsion angles of −123.30 (14), −135.73 (12) and 176.10 (12)°, respectively. In the crystal, N—H⋯O and weak C—H⋯O hydrogen bonds are present, which together with π–π coumarin-ring inter­actions [ring centroid separations = 3.4582 (8) and 3.6421 (9) Å], give rise to a layered structure lying parallel to (001). International Union of Crystallography 2015-11-28 /pmc/articles/PMC4719945/ /pubmed/26870464 http://dx.doi.org/10.1107/S2056989015021982 Text en © Moriguchi et al. 2015 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 Data Reports
Moriguchi, Tetsuji
Jalli, Venkataprasad
Krishnamurthy, Suvratha
Tsuge, Akihiko
Yoja, Kenji
Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title_full Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title_fullStr Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title_full_unstemmed Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title_short Crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2H-chromen-3-yl)methyl acetate
title_sort crystal structure of (tert-butyl­carbamo­yl)(4-chloro-2-oxo-2h-chromen-3-yl)methyl acetate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719945/
https://www.ncbi.nlm.nih.gov/pubmed/26870464
http://dx.doi.org/10.1107/S2056989015021982
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