HRID109363

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

HCID11020917

未命名化合物

HCID55029873

未命名化合物

PRODUCTS

生成物

结构：Cc1c(C(=O)Nc2ccc(OCCOC3CCCCO3)cc2)nnn1Cc1ccc(Cl)c(Cl)c1

HCID59583419

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-207ad23439b64371bba41cc58d54d225
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Cl:1][c:2]1[cH:3][c:4]([CH2:9][n:10]2[n:11][n:12][c:13]([C:16](=[O:17])[OH:18])[c:14]2[CH3:15])[cH:5][cH:6][c:7]1[Cl:8].[O:19]1[CH:20]([O:25][CH2:26][CH2:27][O:28][c:29]2[cH:30][cH:31][c:32]([NH2:33])[cH:34][cH:35]2)[CH2:21][CH2:22][CH2:23][CH2:24]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[P-:36]([F:37])([F:38])([F:39])([F:40])([F:41])[F:42].[n:43]1([O:44][C:45]([N:46]([CH3:47])[CH3:48])=[N+:49]([CH3:50])[CH3:51])[c:52]2[n:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[Cl:1][c:2]1[cH:3][c:4]([CH2:9][n:10]2[n:11][n:12][c:13]([C:16](=[O:18])[NH:33][c:32]3[cH:31][cH:30][c:29]([O:28][CH2:27][CH2:26][O:25][CH:20]4[O:19][CH2:24][CH2:23][CH2:22][CH2:21]4)[cH:35][cH:34]3)[c:14]2[CH3:15])[cH:5][cH:6][c:7]1[Cl:8]