HRID1202866

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID107604

Methyl 4-bromobutyrate

C5H9BrO2

结构：Cc1cc2cccnc2c(N2CCCN(C(=O)OC(C)(C)C)CC2)c1O

HCID135997273

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CCCOc1c(C)cc2cccnc2c1N1CCCN(C(=O)OC(C)(C)C)CC1

HCID59366175

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4456447ff5dc46fb949f3ecfd0d82778
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:27][CH2:28][CH2:29][CH2:30][C:31](=[O:32])[O:33][CH3:34].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:15]2[c:16]([OH:26])[c:17]([CH3:25])[cH:18][c:19]3[cH:20][cH:21][cH:22][n:23][c:24]23)[CH2:12][CH2:13][CH2:14]1.[C:35](=[O:36])([O-:37])[O-:38].[Cl:46][CH2:47][Cl:48].[Cs+:39].[Cs+:40].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:15]2[c:16]([O:26][CH2:28][CH2:29][CH2:30][C:31](=[O:32])[O:33][CH3:34])[c:17]([CH3:25])[cH:18][c:19]3[cH:20][cH:21][cH:22][n:23][c:24]23)[CH2:12][CH2:13][CH2:14]1