HRID144415

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7839

1,2-Dibromoethane

C2H4Br2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC(C)(C)OC(=O)n1nc(-c2cc3cc(O)ccc3n2C(=O)OC(C)(C)C)c2cc(OCc3ccccc3)ccc21

HCID57562414

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)n1nc(-c2cc3cc(OCCBr)ccc3n2C(=O)OC(C)(C)C)c2cc(OCc3ccccc3)ccc21

HCID57562451

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d03df0dcdb52411b93cbc03c99a6066f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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