HRID283041

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID22273643

4-Bromo-1H-pyrrolo[2,3-b]pyridine

C7H5BrN2

结构：COc1ccc(Cn2cc(B3OC(C)(C)C(C)(C)O3)c(-c3ccc([N+](=O)[O-])cc3)n2)cc1

HCID69000582

1-{[4-(methyloxy)phenyl]methyl}-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C23H26BN3O5

PRODUCTS

生成物

结构：COc1ccc(Cn2cc(-c3ccnc4[nH]ccc34)c(-c3ccc([N+](=O)[O-])cc3)n2)cc1

HCID68999259

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c53affc0a5040fd9fc9f087f16c279f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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