HRID1122963

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID27099

Copper(2+)

Cu+2

HCID74299

Benzeneboronic acid, p-chloro-

C6H6BClO2

HCID2756816

tert-Butyl 3-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate

C12H22N2O4

PRODUCTS

生成物

结构：COC(=O)CC1CN(C(=O)OC(C)(C)C)CCN1c1ccc(Cl)cc1

HCID66758668

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b24484d21b949cbaca5174d2ca011c8
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:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[N:18]1[CH2:19][CH:20]([CH2:24][C:25](=[O:26])[O:27][CH3:28])[NH:21][CH2:22][CH2:23]1.[C:38]([O-:39])(=[O:40])[CH3:41].[C:43]([O-:44])(=[O:45])[CH3:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([B:8]([OH:9])[OH:10])[cH:6][cH:7]1.[Cl:35][CH2:36][Cl:37].[Cu+2:42].[cH:29]1[cH:30][cH:31][n:32][cH:33][cH:34]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:21]2[CH:20]([CH2:24][C:25](=[O:26])[O:27][CH3:28])[CH2:19][N:18]([C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:17])[CH2:23][CH2:22]2)[cH:6][cH:7]1