HRID1125145

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(-c3ccc(OCc4ccccc4)cc3)c(-c3ccc(OCc4ccccc4)cc3)cc12

HCID22319504

未命名化合物

PRODUCTS

生成物

结构：CCCC(=O)Nc1n[nH]c2cc(-c3ccc(OCc4ccccc4)cc3)c(-c3ccc(OCc4ccccc4)cc3)cc12

HCID22319668

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e2012d2a10264d8285be2b0aab154d2e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:2][CH2:3][CH2:4][CH2:5][N+:6]([CH2:7][CH2:8][CH2:9][CH3:10])([CH2:11][CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH2:17][CH3:18].[CH3:70][CH2:71][O:72][C:73](=[O:74])[CH3:75].[F-:1].[O:76]1[CH2:77][CH2:78][CH2:79][CH2:80]1.[c:19]1([CH2:25][O:26][c:27]2[cH:28][cH:29][c:30](-[c:33]3[cH:34][c:35]4[c:36]([NH:64][C:65]([CH2:66][CH2:67][CH3:68])=[O:69])[n:37][n:38]([CH2:56][O:57][CH2:58][CH2:59][Si:60]([CH3:61])([CH3:62])[CH3:63])[c:39]4[cH:40][c:41]3-[c:42]3[cH:43][cH:44][c:45]([O:48][CH2:49][c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:46][cH:47]3)[cH:31][cH:32]2)[cH:20][cH:21][cH:22][cH:23][cH:24]1>>[c:19]1([CH2:25][O:26][c:27]2[cH:28][cH:29][c:30](-[c:33]3[cH:34][c:35]4[c:36]([NH:64][C:65]([CH2:66][CH2:67][CH3:68])=[O:69])[n:37][nH:38][c:39]4[cH:40][c:41]3-[c:42]3[cH:43][cH:44][c:45]([O:48][CH2:49][c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:46][cH:47]3)[cH:31][cH:32]2)[cH:20][cH:21][cH:22][cH:23][cH:24]1