HRID300285

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID74811

3-Methyl-4-aminopyridine

C6H8N2

HCID3280088

未命名化合物

结构：COc1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2)c2cc(C(=O)C3CC3)oc12

HCID54127706

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2ccncc2C)c2cc(C(=O)C3CC3)oc12

HCID54462484

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fbdca462f54b4a8aad96b65047fbd64a
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

[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[CH3:9][Si:10]([CH3:11])([CH3:12])[N-:13][Si:14]([CH3:15])([CH3:16])[CH3:17].[N+:19]([c:20]1[cH:21][cH:22][c:23]([O:28][C:29](=[O:24])[c:31]2[cH:32][cH:33][c:34]([O:45][CH3:46])[c:35]3[c:36]2[cH:37][c:38]([C:40](=[O:41])[CH:42]2[CH2:43][CH2:44]2)[o:39]3)[cH:25][cH:26]1)([O-:27])=[O:30].[NH2:1][c:2]1[c:3]([CH3:8])[cH:4][n:5][cH:6][cH:7]1.[Na+:18].[OH2:47]>>[NH:1]([c:2]1[c:3]([CH3:8])[cH:4][n:5][cH:6][cH:7]1)[C:29](=[O:28])[c:31]1[cH:32][cH:33][c:34]([O:45][CH3:46])[c:35]2[c:36]1[cH:37][c:38]([C:40](=[O:41])[CH:42]1[CH2:43][CH2:44]1)[o:39]2