HRID693788

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

3 次

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

HCID16028

Tetrabutylammonium

C16H36N+

3 次

HCID237789

N-[2-(4-Acetylphenyl)ethyl]ethanimidic acid

C12H15NO2

PRODUCTS

生成物

HCID18523617

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e6224fa11d0456ab168e45451743fc4
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

[Br-:18].[Br-:19].[Br-:20].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][NH:12][C:13]([CH3:14])=[O:15])[cH:8][cH:9]1.[CH2:21]([N+:22]([CH2:23][CH2:24][CH2:25][CH3:26])([CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH2:32][CH2:33][CH3:34])[CH2:35][CH2:36][CH3:37].[CH2:38]([N+:39]([CH2:40][CH2:41][CH2:42][CH3:43])([CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH3:54].[CH2:55]([N+:56]([CH2:57][CH2:58][CH2:59][CH3:60])([CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH2:67][CH3:68])[CH2:69][CH2:70][CH3:71].[CH2:72]([Cl:73])[Cl:74].[CH3:16][OH:17]>>[C:1]([CH2:2][Br:18])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][NH:12][C:13]([CH3:14])=[O:15])[cH:8][cH:9]1