HRID1142451

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11575

Benzene, iodo-

C6H5I

HCID19660

Carbonate

CO3-2

HCID24350

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

CuI

HCID74265

1,10-Phenanthroline, 3,4,7,8-tetramethyl-

C16H16N2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC(C)(C)OC(=O)N1CC(O)CC1C(=O)N1CCCN(C2CCC2)CC1

HCID75077680

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CC(Oc2ccccc2)CC1C(=O)N1CCCN(C2CCC2)CC1

HCID75077755

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a20cc298035244ec8144679eebabd388
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([CH:23]3[CH2:24][CH2:25][CH2:26]3)[CH2:20][CH2:21][CH2:22]2)[CH2:10][CH:11]([OH:13])[CH2:12]1.[C:52](=[O:53])([O-:54])[O-:55].[CH3:34][c:35]1[cH:36][n:37][c:38]2[c:39]([c:40]1[CH3:41])[cH:42][cH:43][c:44]1[c:45]2[n:46][cH:47][c:48]([CH3:49])[c:50]1[CH3:51].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Cs+:56].[Cs+:57].[Cu:65][I:66].[I:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([CH:23]3[CH2:24][CH2:25][CH2:26]3)[CH2:20][CH2:21][CH2:22]2)[CH2:10][CH:11]([O:13][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[CH2:12]1