HRID1543837

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3301

Ethylenediamine

C2H8N2

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID31275

1,4-Dioxane

C4H8O2

HCID87073

p-Iodocumene

C9H11I

HCID104967

Cesium(1+)

Cs+

2 次

HCID11673246

未命名化合物

PRODUCTS

生成物

结构：CCc1cccc(CC)c1-c1cc2ccn(-c3ccc(C(C)C)cc3)c2cn1

HCID58269945

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bdd5a8fa624c40e18811cc4ca493d044
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:30](=[O:31])([O-:32])[O-:33].[CH2:1]([CH3:2])[c:3]1[c:4](-[c:11]2[cH:12][c:13]3[c:14]([cH:15][n:16]2)[nH:17][cH:18][cH:19]3)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1.[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cs+:34].[Cs+:35].[Cu:52][I:53].[I:20][c:21]1[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]1.[NH2:36][CH2:37][CH2:38][NH2:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1>>[CH2:1]([CH3:2])[c:3]1[c:4](-[c:11]2[cH:12][c:13]3[c:14]([cH:15][n:16]2)[n:17](-[c:21]2[cH:22][cH:23][c:24]([CH:27]([CH3:28])[CH3:29])[cH:25][cH:26]2)[cH:18][cH:19]3)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1