HRID813636

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID9886

Hexafluorophosphate ion

F6P-

HCID31275

1,4-Dioxane

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID16795996

未命名化合物

HCID67367966

未命名化合物

PRODUCTS

生成物

结构：C=C1CCN(C(=O)c2cccnc2Oc2cc(Cl)ccc2Cl)c2ccccc21

HCID46195420

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a833e6e900d247bb934f4b27b3053a99
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([O:2][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11](=[CH2:18])[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]21)([CH3:3])([CH3:4])[CH3:5].[CH2:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH:42]([CH3:43])[CH3:44])[CH3:45].[Cl:19][c:20]1[c:21]([O:22][c:23]2[c:24]([C:25]([OH:26])=[O:27])[cH:28][cH:29][cH:30][n:31]2)[cH:32][c:33]([Cl:36])[cH:34][cH:35]1.[ClH:70].[O:71]1[CH2:72][CH2:73][O:74][CH2:75][CH2:76]1.[P-:46]([F:47])([F:48])([F:49])([F:50])([F:51])[F:52].[n:53]1([O:54][C:55]([N:56]([CH3:57])[CH3:58])=[N+:59]([CH3:60])[CH3:61])[c:62]2[n:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[C:6](=[O:7])([N:8]1[CH2:9][CH2:10][C:11](=[CH2:18])[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]21)[c:24]1[c:23]([O:22][c:21]2[c:20]([Cl:19])[cH:35][cH:34][c:33]([Cl:36])[cH:32]2)[n:31][cH:30][cH:29][cH:28]1