HRID1218667

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID19220

1-Benzyl-4-piperidone

C12H15NO

HCID28486

Lithium ion

Li+

HCID142032

Acetamide, N-(4-methoxyphenyl)-N-methyl-

C10H13NO2

HCID5062348

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：COc1ccc(N(C)C(=O)CC2(O)CCN(Cc3ccccc3)CC2)cc1

HCID9907318

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b14d6e70081d4f17ace59e6f69da686d
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

[CH2:29]([Li:30])[CH2:31][CH2:32][CH3:33].[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[N:41]1[CH2:42][CH2:43][C:44](=[O:47])[CH2:45][CH2:46]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:7]([C:8]([CH3:9])=[O:10])[CH3:11])[cH:12][cH:13]1.[CH:14]([N-:15][CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[CH:22]([NH:23][CH:24]([CH3:25])[CH3:26])([CH3:27])[CH3:28].[Li+:21].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[OH2:48]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:7]([C:8]([CH2:9][C:44]2([OH:47])[CH2:43][CH2:42][N:41]([CH2:34][c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[CH2:46][CH2:45]2)=[O:10])[CH3:11])[cH:12][cH:13]1