HRID319506

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(=O)c1nn(C)c(-c2ccc(C(F)(F)F)cc2)c1O

HCID60206790

未命名化合物

HCID66986356

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C(=O)NN=C(C)c2nn(C)c(-c3ccc(C(F)(F)F)cc3)c2O)cc1[N+](=O)[O-]

HCID72359982

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c666682354d248f19a452a45b786c053
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

[N+:21](=[O:22])([O-:23])[c:24]1[c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30][cH:31][c:32]([C:34](=[O:35])[NH:36][NH2:37])[cH:33]1.[OH:1][c:2]1[c:3]([C:18]([CH3:19])=[O:20])[n:4][n:5]([CH3:17])[c:6]1-[c:7]1[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1>>[OH:1][c:2]1[c:3]([C:18]([CH3:19])=[N:37][NH:36][C:34]([c:32]2[cH:31][cH:30][c:25]([C:26](=[O:27])[O:28][CH3:29])[c:24]([N+:21](=[O:22])[O-:23])[cH:33]2)=[O:35])[n:4][n:5]([CH3:17])[c:6]1-[c:7]1[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1