HRID296470

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

结构：CC(C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1

HCID693119

未命名化合物

HCID7127806

3-piperidin-1-ylaniline

C11H16N2

PRODUCTS

生成物

结构：CC(C)OC(=O)c1ccc(Nc2cccc(N3CCCCC3)c2)c([N+](=O)[O-])c1

HCID22741931

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3170b0e874ce444f803de9262196f3e8
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

[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:37][N:38]1[CH2:39][CH2:40][CH2:41][C:42]1=[O:43].[Cl:1][c:2]1[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([C:6](=[O:7])[O:8][CH:9]([CH3:10])[CH3:11])[cH:12][cH:13]1.[N:17]1([c:23]2[cH:24][c:25]([NH2:26])[cH:27][cH:28][cH:29]2)[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]1>>[c:2]1([NH:26][c:25]2[cH:24][c:23]([N:17]3[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]3)[cH:29][cH:28][cH:27]2)[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([C:6](=[O:7])[O:8][CH:9]([CH3:10])[CH3:11])[cH:12][cH:13]1