HRID672521

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1346

Ortho-Methoxyphenylpiperazine

C11H16N2O

HCID6344

Dichloromethane

CH2Cl2

HCID166653

Hydride

H-

HCID425307

未命名化合物

HCID12018120

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1N1CCN(CCC(C(=O)c2ccccc2)c2ccccc2)CC1

HCID15524025

4-[4-(2-Methoxyphenyl)piperazin-1-yl]-1,2-diphenylbutan-1-one

C27H30N2O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-db97a8cb7ebb40328b82ff58477b425c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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