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Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate

In the title compound, C(15)H(18)N(4)O(4), the 1H-imidazole ring forms a dihedral angle of 67.12 (8)° with the benzene ring. An S(6) ring motif is formed via an intra­molecular N—H⋯O hydrogen bond. In the crystal, neighbouring mol­ecules are linked by a pair of inter­molecular N—H⋯N hydrogen bonds,...

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Autores principales: Yoon, Yeong Keng, Ali, Mohamed Ashraf, Choon, Tan Soo, Loh, Wan-Sin, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201243/
https://www.ncbi.nlm.nih.gov/pubmed/22058754
http://dx.doi.org/10.1107/S1600536811036300
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author Yoon, Yeong Keng
Ali, Mohamed Ashraf
Choon, Tan Soo
Loh, Wan-Sin
Fun, Hoong-Kun
author_facet Yoon, Yeong Keng
Ali, Mohamed Ashraf
Choon, Tan Soo
Loh, Wan-Sin
Fun, Hoong-Kun
author_sort Yoon, Yeong Keng
collection PubMed
description In the title compound, C(15)H(18)N(4)O(4), the 1H-imidazole ring forms a dihedral angle of 67.12 (8)° with the benzene ring. An S(6) ring motif is formed via an intra­molecular N—H⋯O hydrogen bond. In the crystal, neighbouring mol­ecules are linked by a pair of inter­molecular N—H⋯N hydrogen bonds, forming an inversion dimer. The dimers are further linked by a pair of C—H⋯O hydrogen bonds, leading to the formation of chain along [021]. A C—H⋯π inter­action involving the centroid of the benzene ring is also observed between the chains.
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spelling pubmed-32012432011-11-06 Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate Yoon, Yeong Keng Ali, Mohamed Ashraf Choon, Tan Soo Loh, Wan-Sin Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(18)N(4)O(4), the 1H-imidazole ring forms a dihedral angle of 67.12 (8)° with the benzene ring. An S(6) ring motif is formed via an intra­molecular N—H⋯O hydrogen bond. In the crystal, neighbouring mol­ecules are linked by a pair of inter­molecular N—H⋯N hydrogen bonds, forming an inversion dimer. The dimers are further linked by a pair of C—H⋯O hydrogen bonds, leading to the formation of chain along [021]. A C—H⋯π inter­action involving the centroid of the benzene ring is also observed between the chains. International Union of Crystallography 2011-09-14 /pmc/articles/PMC3201243/ /pubmed/22058754 http://dx.doi.org/10.1107/S1600536811036300 Text en © Yoon et al. 2011 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
Yoon, Yeong Keng
Ali, Mohamed Ashraf
Choon, Tan Soo
Loh, Wan-Sin
Fun, Hoong-Kun
Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title_full Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title_fullStr Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title_full_unstemmed Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title_short Ethyl 4-[3-(1H-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
title_sort ethyl 4-[3-(1h-imidazol-1-yl)propyl­amino]-3-nitro­benzoate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201243/
https://www.ncbi.nlm.nih.gov/pubmed/22058754
http://dx.doi.org/10.1107/S1600536811036300
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