HRID681202

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate Ion

CO3-2

HCID2733990

4-phenethylbenzyl chloride

C15H15Cl

HCID67353032

未命名化合物

PRODUCTS

产物

HCID68660596

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-27854e94f9554984ab8280caa89df520
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:17](=[O:18])([O-:19])[O-:20].[C:23](#[N:24])[c:25]1[cH:26][cH:27][c:28]([CH2:31][CH2:32][CH:33]([CH2:34][c:35]2[cH:36][cH:37][c:38]([C:39](=[O:40])[O:41][CH3:42])[cH:43][cH:44]2)[CH:45]=[CH:46][c:47]2[c:48]([OH:53])[cH:49][cH:50][cH:51][cH:52]2)[cH:29][cH:30]1.[CH3:54][C:55]#[N:56].[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[cH:7][cH:8]1.[K+:21].[K+:22]>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[cH:7][cH:8]1)[O:53][c:48]1[c:47]([CH:46]=[CH:45][CH:33]([CH2:32][CH2:31][c:28]2[cH:27][cH:26][c:25]([C:23]#[N:24])[cH:30][cH:29]2)[CH2:34][c:35]2[cH:36][cH:37][c:38]([C:39](=[O:40])[O:41][CH3:42])[cH:43][cH:44]2)[cH:52][cH:51][cH:50][cH:49]1