HRID207298

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9025

1,3-Dimethoxybenzene

C8H10O2

HCID245494

Methyl 2-bromo-5-nitrobenzoate

C8H6BrNO4

HCID612296

2-Bromo-1,3-dimethoxybenzene

C8H9BrO2

HCID3587356

未命名化合物

HCID11391407

2-iodo-1,3-dimethoxybenzene

C8H9IO2

PRODUCTS

生成物

结构：COC(=O)c1cc([N+](=O)[O-])ccc1-c1c(OC)cccc1OC

HCID11001627

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5b7f55bb3b0240088e02f4b09631fc3d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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