HRID1205695

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID88737

Heptanenitrile, 7-bromo-

C7H12BrN

HCID3280088

未命名化合物

结构：CC(C)(C)[Si](C)(C)OC(CCC1CCC(=O)N1)Cc1cccc(-c2ccccc2)c1

HCID22712479

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OC(CCC1CCC(=O)N1CCCCCCC#N)Cc1cccc(-c2ccccc2)c1

HCID22718766

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4db2856ba07c4575bc44c57422a0cb6f
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

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