HRID686556

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID4067207

3-Methoxybenzyl bromide

C8H9BrO

反应SMILES：CCOC(=O)C(C)(Cc1ccc(OCCC2CNC(=O)N2C)cc1)Oc1ccccc1

HCID68867446

未命名化合物

PRODUCTS

产物

反应SMILES：CCOC(=O)C(C)(Cc1ccc(OCCC2CN(Cc3cccc(OC)c3)C(=O)N2C)cc1)Oc1ccccc1

HCID68869679

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-318845d819d84c178874ce67a7aa62d4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][CH2:15][CH:16]2[N:17]([CH3:22])[C:18](=[O:21])[NH:19][CH2:20]2)[cH:11][cH:12]1)([O:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[CH3:30])=[O:31].[CH2:50]([N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH3:66].[CH3:34][O:35][c:36]1[cH:37][c:38]([CH2:39][Br:40])[cH:41][cH:42][cH:43]1.[H-:33].[I-:49].[Na+:32].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][CH2:15][CH:16]2[N:17]([CH3:22])[C:18](=[O:21])[N:19]([CH2:39][c:38]3[cH:37][c:36]([O:35][CH3:34])[cH:43][cH:42][cH:41]3)[CH2:20]2)[cH:11][cH:12]1)([O:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[CH3:30])=[O:31]