HRID1220175

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7498

alpha-Bromotoluene

C7H7Br

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC(C)(C)OC(=O)N1CCCC(c2cccc(OC(C)(C)C(=O)O)c2)C1

HCID68886102

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC(c2cccc(OC(C)(C)C(=O)OCc3ccccc3)c2)C1

HCID68884513

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-150926e0fb95453ebc8909b1e9364cdc
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:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1.[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH:24]([c:28]2[cH:29][c:30]([O:34][C:35]([CH3:36])([CH3:37])[C:38](=[O:39])[OH:40])[cH:31][cH:32][cH:33]2)[CH2:25][CH2:26][CH2:27]1.[C:1](=[O:2])([O-:3])[O-:4].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[Cs+:5].[Cs+:6].[OH2:46]>>[CH2:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[O:40][C:38]([C:35]([O:34][c:30]1[cH:29][c:28]([CH:24]2[CH2:23][N:22]([C:20]([O:19][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:21])[CH2:27][CH2:26][CH2:25]2)[cH:33][cH:32][cH:31]1)([CH3:36])[CH3:37])=[O:39]