HRID820688

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID62576

Benzyl bromoacetate

C9H9BrO2

HCID10750663

1H-1-Benzazepine-2,5-dione, 3-methoxy-

C11H9NO3

PRODUCTS

产物

反应SMILES：COc1cc(=O)c2ccccc2n(CC(=O)OCc2ccccc2)c1=O

HCID20244806

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9af97d5951be4d849c84e213137b3cfc
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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