HRID1117808

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID225528

2-bromo-N-(3-methylphenyl)acetamide

C9H10BrNO

HCID16094690

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(NC(=O)CN2CC=C(c3ccc(OCc4ccccc4)cn3)CC2)c1

HCID16094713

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d4dc58b5c6a4c719d8ad1ac9b480840
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:21][CH2:22][C:23](=[O:24])[NH:25][c:26]1[cH:27][c:28]([CH3:32])[cH:29][cH:30][cH:31]1.[C:33](=[O:34])([O-:35])[O-:36].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([C:15]2=[CH:20][CH2:19][NH:18][CH2:17][CH2:16]2)[n:13][cH:14]1.[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[K+:37].[K+:38].[OH2:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([C:15]2=[CH:20][CH2:19][N:18]([CH2:22][C:23](=[O:24])[NH:25][c:26]3[cH:27][c:28]([CH3:32])[cH:29][cH:30][cH:31]3)[CH2:17][CH2:16]2)[n:13][cH:14]1