HRID1127651

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

HCID6328

Methyl iodide

CH3I

HCID19660

Carbonate

CO3-2

结构：CC(C)(C)OC(=O)N1CCC(NN2CCN(C(=O)OCc3ccccc3)CC2=O)CC1

HCID17825389

未命名化合物

PRODUCTS

生成物

结构：CN(C1CCN(C(=O)OC(C)(C)C)CC1)N1CCN(C(=O)OCc2ccccc2)CC1=O

HCID22727106

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7178803f73344d99606d2f9a6c0aeec
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

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