HRID1220989

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12361

Ethanol, 2-(2-chloroethoxy)-

C4H9ClO2

HCID19660

Carbonate

CO3-2

结构：COc1cc2c(cc1OC)CN(CCCCNC(=O)c1cc(C)ccc1O)CC2

HCID16738306

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(cc1OC)CN(CCCCNC(=O)c1cc(C)ccc1OCCOCCO)CC2

HCID68008900

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd08907d6ca2429bb486780db87244cd
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:37](=[O:38])([O-:39])[O-:40].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:10]([cH:11][c:12]1[O:13][CH3:14])[CH2:9][N:8]([CH2:15][CH2:16][CH2:17][CH2:18][NH:19][C:20]([c:21]1[c:22]([OH:28])[cH:23][cH:24][c:25]([CH3:27])[cH:26]1)=[O:29])[CH2:7][CH2:6]2.[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl:30][CH2:31][CH2:32][O:33][CH2:34][CH2:35][OH:36].[K+:41].[K+:42]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:10]([cH:11][c:12]1[O:13][CH3:14])[CH2:9][N:8]([CH2:15][CH2:16][CH2:17][CH2:18][NH:19][C:20]([c:21]1[c:22]([O:28][CH2:31][CH2:32][O:33][CH2:34][CH2:35][OH:36])[cH:23][cH:24][c:25]([CH3:27])[cH:26]1)=[O:29])[CH2:7][CH2:6]2