HRID126584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID17836487

未命名化合物

结构：CCCCC(C(=O)OC)n1c(=O)[nH]c2cc(OC)ccc2c1=O

HCID68751633

未命名化合物

PRODUCTS

生成物

结构：CCCCC(C(=O)OC)n1c(=O)c2ccc(OC)cc2n(Cc2cn(C)c3cccc(C)c23)c1=O

HCID178445514

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e60edd5d39dc4ae6926b566aeb548566
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][CH2:7][CH3:8])[n:9]1[c:10](=[O:22])[nH:11][c:12]2[cH:13][c:14]([O:20][CH3:21])[cH:15][cH:16][c:17]2[c:18]1=[O:19])=[O:23].[CH3:25][n:26]1[cH:27][c:28]([CH2:36][N+:37]([CH3:38])([CH3:39])[CH3:40])[c:29]2[c:30]([CH3:35])[cH:31][cH:32][cH:33][c:34]12.[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[I-:24].[K+:41].[K+:42].[O-:43][C:44]([O-:45])=[O:46].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][CH2:7][CH3:8])[n:9]1[c:10](=[O:22])[n:11]([CH2:36][c:28]2[cH:27][n:26]([CH3:25])[c:34]3[c:29]2[c:30]([CH3:35])[cH:31][cH:32][cH:33]3)[c:12]2[cH:13][c:14]([O:20][CH3:21])[cH:15][cH:16][c:17]2[c:18]1=[O:19])=[O:23]