HRID155187

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID19266

Acedoben

C9H9NO3

HCID7010341

4-ACETAMIDOBENZOYL CHLORIDE

C9H8ClNO2

结构：CC1(C)OB(c2ccc([N+](=O)[O-])c(N)c2)OC1(C)C

HCID59736976

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1ccc(C(=O)Nc2cc(B3OC(C)(C)C(C)(C)O3)ccc2[N+](=O)[O-])cc1

HCID59736749

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3303c5af9fa6464b9d78acd765bd0ab5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:20]([CH3:21])(=[O:22])[NH:23][c:24]1[cH:25][cH:26][c:27]([C:28](=[O:29])[Cl:30])[cH:31][cH:32]1.[C:33]([NH:34][c:35]1[cH:36][cH:37][c:38]([C:39]([OH:40])=[O:41])[cH:42][cH:43]1)(=[O:44])[CH3:45].[CH3:1][C:2]1([CH3:19])[O:3][B:4]([c:9]2[cH:10][cH:11][c:12]([N+:16](=[O:17])[O-:18])[c:13]([NH2:15])[cH:14]2)[O:5][C:6]1([CH3:7])[CH3:8].[CH3:52][N:53]([CH3:54])[c:55]1[cH:56][cH:57][n:58][cH:59][cH:60]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[CH3:1][C:2]1([CH3:19])[O:3][B:4]([c:9]2[cH:10][cH:11][c:12]([N+:16](=[O:17])[O-:18])[c:13]([NH:15][C:28]([c:27]3[cH:26][cH:25][c:24]([NH:23][C:20]([CH3:21])=[O:22])[cH:32][cH:31]3)=[O:29])[cH:14]2)[O:5][C:6]1([CH3:7])[CH3:8]