HRID290278

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID73895

Benzene, 1-fluoro-2-nitro-

C6H4FNO2

结构：Cc1cc(CC(NC(=O)OC(C)(C)C)c2ncc[nH]2)cc2cn(COCC[Si](C)(C)C)nc12

HCID57794668

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(CC(NC(=O)OC(C)(C)C)c2nccn2-c2ccccc2[N+](=O)[O-])cc2cn(COCC[Si](C)(C)C)nc12

HCID57794697

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c11de9244969414aab15a9dc077e62d3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][c:12]2[cH:13][n:14]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[n:15][c:16]2[c:17]([CH3:19])[cH:18]1)[c:28]1[nH:29][cH:30][cH:31][n:32]1)=[O:33].[C:44](=[O:45])([O-:46])[O-:47].[CH3:50][C:51]#[N:52].[F:34][c:35]1[c:36]([N+:41](=[O:42])[O-:43])[cH:37][cH:38][cH:39][cH:40]1.[K+:48].[K+:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][c:12]2[cH:13][n:14]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[n:15][c:16]2[c:17]([CH3:19])[cH:18]1)[c:28]1[n:29](-[c:35]2[c:36]([N+:41](=[O:42])[O-:43])[cH:37][cH:38][cH:39][cH:40]2)[cH:30][cH:31][n:32]1)=[O:33]