Iodide Ion → (4-Chloro-phenyl)-methyl-carbamic Acid 4-(2-cyano-5-trifluoromethyl-pyridin-3-yloxy)-phenyl Ester

반응식

[C:1](#[N:2])[c:3]1[n:4][cH:5][c:6]([C:17]([F:18])([F:19])[F:20])[cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][c:13]([OH:16])[cH:14][cH:15]1.[Cl:22][c:23]1[cH:24][cH:25][c:26]([N:29]([C:30](=[O:31])[n:32]2[cH:33][cH:34][n+:35]([CH3:36])[cH:37]2)[CH3:38])[cH:27][cH:28]1.[I-:21]>>[C:1](#[N:2])[c:3]1[n:4][cH:5][c:6]([C:17]([F:18])([F:19])[F:20])[cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][c:13]([O:16][C:30]([N:29]([c:26]2[cH:25][cH:24][c:23]([Cl:22])[cH:28][cH:27]2)[CH3:38])=[O:31])[cH:14][cH:15]1

참가 물질

반응물 3

HCID 30165Iodide Ion

HCID 43138633-(4-Hydroxyphenoxy)-5-(trifluoromethyl)pyridine-2-carbonitrile

HCID 22047799N-(4-chlorophenyl)-N,3-dimethylimidazol-3-ium-1-carboxamide

생성물 1

HCID 10151515(4-Chloro-phenyl)-methyl-carbamic Acid 4-(2-cyano-5-trifluoromethyl-pyridin-3-yloxy)-phenyl Ester

출처 및 근거

ORD 기록: ord-6944ec032b0943508f802d7c3a4d3110
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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