HRID934319

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID6328

Methyl iodide

CH3I

结构：COc1ccc(C(C#N)(CCCC2Cc3cc(OC)c(OC)cc3C=N2)C(C)C)cc1OC

HCID20202182

未命名化合物

PRODUCTS

生成物

HCID30165

Iodide ion

I-

结构：COc1ccc(C(C#N)(CCCC2Cc3cc(OC)c(OC)cc3C=[N+]2C)C(C)C)cc1OC

HCID20202212

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-61503a19ce8f4e8e80931b18666daafb
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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