HRID2317074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC(C)(C)OC(=O)Nc1cc2ccn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2cc1F

HCID58998509

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)OC(C)(C)C)c1cc2ccn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2cc1F

HCID58998426

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c8f7c3bb170d4b87b0342c5773b07b38
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][c:10]2[cH:11][cH:12][n:13](-[c:20]3[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]3)[c:14](=[O:19])[c:15]2[cH:16][c:17]1[F:18])=[O:29].[C:30](=[O:31])([O-:32])[O-:33].[CH3:36][I:37].[Cs+:34].[Cs+:35].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([c:8]1[cH:9][c:10]2[cH:11][cH:12][n:13](-[c:20]3[cH:21][cH:22][c:23]([N+:26](=[O:27])[O-:28])[cH:24][cH:25]3)[c:14](=[O:19])[c:15]2[cH:16][c:17]1[F:18])[CH3:30])=[O:29]