HRID285693

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID1049

Pyridine

C5H5N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID82129

Carbonochloridic acid, 4-nitrophenyl ester

C7H4ClNO4

HCID57470256

未命名化合物

PRODUCTS

生成物

结构：CC1(C)CCCN(C(=O)Oc2ccc([N+](=O)[O-])cc2)c2cc([N+](=O)[O-])ccc21

HCID86634058

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cdf99e5fc1c44982ba905183be6b7789
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

[CH3:1][C:2]1([CH3:16])[c:3]2[c:4]([cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]2)[NH:5][CH2:6][CH2:7][CH2:8]1.[CH3:36][N:37]([CH3:38])[c:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1.[Cl:23][C:24](=[O:25])[O:26][c:27]1[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][cH:32]1.[Cl:45][CH2:46][CH2:47][Cl:48].[cH:17]1[cH:18][cH:19][n:20][cH:21][cH:22]1>>[CH3:1][C:2]1([CH3:16])[c:3]2[c:4]([cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]2)[N:5]([C:24](=[O:25])[O:26][c:27]2[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][cH:32]2)[CH2:6][CH2:7][CH2:8]1