HRID701567

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID7638

4-(Benzyloxyl)phenol

C13H12O2

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID10541625

tert-Butyl 4-(2-bromoethyl)piperidine-1-carboxylate

C12H22BrNO2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(CCOc2ccc(OCc3ccccc3)cc2)CC1

HCID59371402

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0925ef69f26a4412a712d7b565da056f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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