HRID2158199

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID74372

Benzoyl chloride, 4-(1,1-dimethylethyl)-

C11H13ClO

HCID22132632

未命名化合物

PRODUCTS

生成物

结构：COc1cc2nccc(Cc3ccc(C(=O)c4ccc(C(C)(C)C)cc4)cc3)c2cc1OC

HCID22132646

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d517f8dc5c04428bb257a1322682146
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:23]([CH3:24])([CH3:25])([CH3:26])[c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[Cl:33])[cH:34][cH:35]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([CH2:15][c:16]3[cH:17][cH:18][c:19]([Br:22])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH:37]([Cl:38])([Cl:39])[Cl:40].[OH2:36]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([CH2:15][c:16]3[cH:17][cH:18][c:19]([C:31]([c:30]4[cH:29][cH:28][c:27]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:35][cH:34]4)=[O:32])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]