HRID2324909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

结构：Cc1cc(Oc2ccc([N+](=O)[O-])c(N(C)C(=O)OC(C)(C)C)c2)cc(C)c1NC(=O)OC(C)(C)C

HCID18184943

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(Oc2ccc(N)c(N(C)C(=O)OC(C)(C)C)c2)cc(C)c1NC(=O)OC(C)(C)C

HCID18184919

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4bba8512b56d469dbf7501c991dfe4f3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([CH3:35])[cH:11][c:12]([O:13][c:14]2[cH:15][cH:16][c:17]([N+:29]([O-:30])=[O:31])[c:18]([N:20]([C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH3:28])[cH:19]2)[cH:32][c:33]1[CH3:34].[CH3:36][OH:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([CH3:35])[cH:11][c:12]([O:13][c:14]2[cH:15][cH:16][c:17]([NH2:29])[c:18]([N:20]([C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH3:28])[cH:19]2)[cH:32][c:33]1[CH3:34]