HRID161977

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID77568

Benzene, 1-(bromomethyl)-3-nitro-

C7H6BrNO2

HCID166653

Hydride

H-

HCID21111385

2-Amino-5-[4-[2-(4-morpholinyl)ethoxy]phenyl]-3-pyridinol

C17H21N3O3

HCID21111386

未命名化合物

PRODUCTS

生成物

结构：Nc1ncc(-c2ccc(OCCN3CCOCC3)cc2)cc1OCc1cccc([N+](=O)[O-])c1

HCID21111304

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b206634fcf894b0eb8ccafc3fc4ebb70
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

[Br:40][CH2:41][c:42]1[cH:43][c:44]([N+:48](=[O:49])[O-:50])[cH:45][cH:46][cH:47]1.[ClH:51].[H-:39].[NH2:1][c:2]1[n:3][cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[cH:13][cH:14]2)[cH:6][c:7]1[OH:8].[NH2:24][c:25]1[c:26]([OH:27])[cH:28][c:29](-[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:36][n:37]1.[Na+:38].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56]>>[NH2:1][c:2]1[n:3][cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[cH:13][cH:14]2)[cH:6][c:7]1[O:8][CH2:41][c:42]1[cH:43][c:44]([N+:48](=[O:49])[O-:50])[cH:45][cH:46][cH:47]1