HRID301601

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID7666

Phenethyl bromide

C8H9Br

HCID19660

Carbonate

CO3-2

反应SMILES：c1ccc(-c2cc(CCC3CCNCC3)c3ccccc3n2)cc1

HCID71219

Pipequaline

C22H24N2

PRODUCTS

产物

反应SMILES：c1ccc(CCN2CCC(CCc3cc(-c4ccccc4)nc4ccccc34)CC2)cc1

HCID3062095

Quinoline, 2-phenyl-4-(2-(1-(2-phenylethyl)-4-piperidinyl)ethyl)-

C30H32N2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-41d3a4e394ac492499b7dfaf4a393d81
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

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