HRID286976

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID192734

5-Hydroxy-3-methylindole

C9H9NO

结构：COc1cc2c(Cl)ncnc2cc1OCC1CCN(C(=O)OC(C)(C)C)CC1

HCID21936046

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc4[nH]cc(C)c4c3)ncnc2cc1OCC1CCN(C(=O)OC(C)(C)C)CC1

HCID22030599

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a9524383c5874808be56e05f3d66fd4c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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