HRID166028

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOC(=O)Cc1ccc(OC)c(B2OC(C)(C)C(C)(C)O2)c1

HCID58120060

[4-Methoxy-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]acetic acid ethyl ester

C17H25BO5

HCID58149219

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)Cc1ccc(OC)c(-c2ccc(Br)cc2CN(CC)C(=O)OC(C)(C)C)c1

HCID58148864

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a78a4e1c0efd42c0ac2662baf1838c60
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH3:9])[CH2:10][c:11]1[c:12]([I:18])[cH:13][cH:14][c:15]([Br:17])[cH:16]1)=[O:19].[CH2:20]([CH3:21])[O:22][C:23]([CH2:24][c:25]1[cH:26][c:27]([B:33]2[O:34][C:35]([CH3:36])([CH3:37])[C:38]([CH3:39])([CH3:40])[O:41]2)[c:28]([O:31][CH3:32])[cH:29][cH:30]1)=[O:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH3:9])[CH2:10][c:11]1[c:12](-[c:27]2[cH:26][c:25]([CH2:24][C:23]([O:22][CH2:20][CH3:21])=[O:42])[cH:30][cH:29][c:28]2[O:31][CH3:32])[cH:13][cH:14][c:15]([Br:17])[cH:16]1)=[O:19]