HRID154594

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID85239

2,6-Dichloro-3-nitropyridine

C5H2Cl2N2O2

HCID105034

Isocyanate

CNO-

HCID714952

Bis(4-methoxybenzyl)amine

C16H19NO2

PRODUCTS

生成物

结构：COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(Cl)ccc2[N+](=O)[O-])cc1

HCID59595987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91b74712385645c98024debe1463da3b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][NH:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[cH:18][cH:19]1.[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH:41]([Cl:42])([Cl:43])[Cl:44].[Cl:27][c:28]1[n:29][c:30]([Cl:37])[cH:31][cH:32][c:33]1[N+:34](=[O:35])[O-:36].[Cl:45][CH2:46][Cl:47].[N-:38]=[C:39]=[O:40]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[c:28]2[n:29][c:30]([Cl:37])[cH:31][cH:32][c:33]2[N+:34](=[O:35])[O-:36])[cH:18][cH:19]1