HRID314414

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID6422

未命名化合物

结构：Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)c1cc(F)c(F)c(N)c1F

HCID59226938

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)c1cc(F)c(F)c([N+](=O)[O-])c1F

HCID59226973

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a84ac74cc379469e889f7dd3980d7463
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

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