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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,...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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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. |
format | Online Article Text |
id | pubmed-3201243 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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