HRID1236362

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID27099

Copper(2+)

Cu+2

HCID104967

Cesium(1+)

Cs+

2 次

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

2 次

HCID10609021

4-[2-(Piperidin-1-yl)ethoxy]phenol

C13H19NO2

HCID11702908

2-benzyloxy-1-bromo-6-methoxy-naphthalene

C18H15BrO2

PRODUCTS

生成物

结构：COc1ccc2c(Oc3ccc(OCCN4CCCCC4)cc3)c(OCc3ccccc3)ccc2c1

HCID11677433

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-155c3ceb05f74d269fea673545229e50
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:38](=[O:39])([O-:40])[O-:41].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([Br:21])[c:11]2[cH:12][cH:13][c:14]([O:19][CH3:20])[cH:15][c:16]2[cH:17][cH:18]1.[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[Cs+:42].[Cs+:43].[Cu+2:64].[N:22]1([CH2:28][CH2:29][O:30][c:31]2[cH:32][cH:33][c:34]([OH:37])[cH:35][cH:36]2)[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1.[S:56]([O-:57])([C:58]([F:59])([F:60])[F:61])(=[O:62])=[O:63].[S:65]([O-:66])([C:67]([F:68])([F:69])[F:70])(=[O:71])=[O:72].[cH:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:37][c:34]2[cH:33][cH:32][c:31]([O:30][CH2:29][CH2:28][N:22]3[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]3)[cH:36][cH:35]2)[c:11]2[cH:12][cH:13][c:14]([O:19][CH3:20])[cH:15][c:16]2[cH:17][cH:18]1