HRID1220436

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID12509263

未命名化合物

HCID53395268

1-(Piperazin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

C16H22N2O4

PRODUCTS

生成物

结构：COc1cc(C=CC(=O)N2CCN(C(C)C(=O)NC(C)C)CC2)cc(OC)c1OC

HCID54378678

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0aa262351e6e478eb5ffeb1560a07c69
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:1](=[O:2])([O-:3])[O-:4].[CH3:16][O:17][c:18]1[cH:19][c:20]([CH:21]=[CH:22][C:23](=[O:24])[N:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[cH:31][c:32]([O:36][CH3:37])[c:33]1[O:34][CH3:35].[CH3:38][CH2:39][OH:40].[CH:7]([CH3:8])([CH3:9])[NH:10][C:11]([CH:12]([CH3:13])[Br:14])=[O:15].[K+:5].[K+:6]>>[CH:7]([CH3:8])([CH3:9])[NH:10][C:11]([CH:12]([CH3:13])[N:28]1[CH2:27][CH2:26][N:25]([C:23]([CH:22]=[CH:21][c:20]2[cH:19][c:18]([O:17][CH3:16])[c:33]([O:34][CH3:35])[c:32]([O:36][CH3:37])[cH:31]2)=[O:24])[CH2:30][CH2:29]1)=[O:15]