HRID88040

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6946

2-Nitrobenzenamine

C6H6N2O2

2 次

HCID8857

Ethyl acetate

C4H8O2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID506050

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])cc1

HCID14054010

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-54bc3cab883743abb1743354a4111040
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

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