HRID2131714

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID2736444

tert-butyl 4-fluorobenzoate

C11H13FO2

HCID10261546

methyl 3-(piperidin-4-yl)propanoate

C9H17NO2

PRODUCTS

生成物

结构：COC(=O)CCC1CCN(c2ccc(C(=O)OC(C)(C)C)cc2)CC1

HCID86663456

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be2fcf819fd646b692ded82af80ae052
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:27](=[O:28])([O-:29])[O-:30].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[F:13][c:14]1[cH:15][cH:16][c:17]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26]1.[K+:31].[K+:32].[NH:1]1[CH2:2][CH2:3][CH:4]([CH2:7][CH2:8][C:9](=[O:10])[O:11][CH3:12])[CH2:5][CH2:6]1.[Na+:33].[OH:34][C:35](=[O:36])[O-:37]>>[N:1]1([c:14]2[cH:15][cH:16][c:17]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26]2)[CH2:2][CH2:3][CH:4]([CH2:7][CH2:8][C:9](=[O:10])[O:11][CH3:12])[CH2:5][CH2:6]1