HRID1544262

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID166653

Hydride

H-

结构：CC(C)(C)NC(=O)C1CCC(O)CC1CC1OC(C)(C)N(C(=O)OC(C)(C)C)C1Cc1ccccc1

HCID69853541

未命名化合物

PRODUCTS

生成物

结构：COC1CCC(C(=O)NC(C)(C)C)C(CC2OC(C)(C)N(C(=O)OC(C)(C)C)C2Cc2ccccc2)C1

HCID69862800

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ddecd3042c1e42be8d2d900ca5b7e194
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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