HRID1213884

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID27099

Copper(2+)

Cu+2

HCID2734369

[4-(Methoxycarbonyl)phenyl]boronic acid

C8H9BO4

结构：CC(C)(C)OC(=O)N(CCc1ccc(O)cc1)CC(O)c1cccc(Cl)c1

HCID178453298

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Oc2ccc(CCN(CC(O)c3cccc(Cl)c3)C(=O)OC(C)(C)C)cc2)cc1

HCID178498213

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-95105775c6ca46d6beee4863267d254a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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