HRID185908

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID2773210

4-aminomethyltetrahydropyran

C6H13NO

结构：O=[N+]([O-])c1cnc2cc(OCc3ccccc3)ccc2c1Cl

HCID21075751

7-(Benzyloxy)-4-chloro-3-nitroquinoline

C16H11ClN2O3

PRODUCTS

生成物

结构：O=[N+]([O-])c1cnc2cc(OCc3ccccc3)ccc2c1NCC1CCOCC1

HCID67051153

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f418b0904374781b50d2d016c079d33
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[O:16][c:17]1[cH:18][cH:19][c:20]2[c:21]([Cl:30])[c:22]([N+:27](=[O:28])[O-:29])[cH:23][n:24][c:25]2[cH:26]1.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][NH2:8])[CH2:5][CH2:6]1.[OH2:38]>>[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][NH:8][c:21]2[c:20]3[cH:19][cH:18][c:17]([O:16][CH2:9][c:10]4[cH:11][cH:12][cH:13][cH:14][cH:15]4)[cH:26][c:25]3[n:24][cH:23][c:22]2[N+:27](=[O:28])[O-:29])[CH2:5][CH2:6]1