HRID1214224

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID19660

Carbonate

CO3-2

HCID7010304

1-Boc-piperidine

C10H19NO2

结构：COC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cc(OCCBr)ccc1OCc1ccccc1

HCID66990627

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cc(OCCC2CCN(C(=O)OC(C)(C)C)CC2)ccc1OCc1ccccc1

HCID66991035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de1288443a3c4176bed57815de060b6b
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:1](=[O:2])([O-:3])[O-:4].[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12](=[O:13])[N:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1.[CH2:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[O:34][c:35]1[c:36]([C:37](=[O:38])[NH:39][c:40]2[c:41]([C:42](=[O:43])[O:44][CH3:45])[cH:46][cH:47][c:48](-[c:50]3[cH:51][cH:52][cH:53][cH:54][cH:55]3)[cH:49]2)[cH:56][c:57]([O:60][CH2:61][CH2:62][Br:63])[cH:58][cH:59]1.[CH3:20][N:21]1[CH2:22][CH2:23][CH2:24][C:25]1=[O:26].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[K+:5].[K+:6].[OH2:70]>>[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12](=[O:13])[N:14]1[CH2:15][CH2:16][CH:17]([CH2:62][CH2:61][O:60][c:57]2[cH:56][c:36]([C:37](=[O:38])[NH:39][c:40]3[c:41]([C:42](=[O:43])[O:44][CH3:45])[cH:46][cH:47][c:48](-[c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:49]3)[c:35]([O:34][CH2:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:59][cH:58]2)[CH2:18][CH2:19]1