HRID1210869

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

HCID19660

Carbonate

CO3-2

结构：Cc1ccc(S(=O)(=O)OCC2CCN(C(=O)OC(C)(C)C)CC2)cc1

HCID10642851

tert-Butyl 4-{[(4-methylbenzene-1-sulfonyl)oxy]methyl}piperidine-1-carboxylate

C18H27NO5S

结构：COc1cc2c(Oc3ccc4[nH]cc(C)c4c3)ncnc2cc1O

HCID135763115

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc4[nH]cc(C)c4c3)ncnc2cc1OCC1CCN(C(=O)OC(C)(C)C)CC1

HCID22030599

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f70e9b5212724462ac4962aa7925028d
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:25](=[O:26])([O-:27])[O-:28].[CH3:31][c:32]1[cH:33][cH:34][c:35]([S:36]([O:37][CH2:42][CH:43]2[CH2:44][CH2:45][N:46]([C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[CH2:47][CH2:48]2)(=[O:38])=[O:39])[cH:40][cH:41]1.[K+:29].[K+:30].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[OH:1][c:2]1[c:3]([O:23][CH3:24])[cH:4][c:5]2[c:6]([O:12][c:13]3[cH:14][c:15]4[c:16]([CH3:22])[cH:17][nH:18][c:19]4[cH:20][cH:21]3)[n:7][cH:8][n:9][c:10]2[cH:11]1>>[O:1]([c:2]1[c:3]([O:23][CH3:24])[cH:4][c:5]2[c:6]([O:12][c:13]3[cH:14][c:15]4[c:16]([CH3:22])[cH:17][nH:18][c:19]4[cH:20][cH:21]3)[n:7][cH:8][n:9][c:10]2[cH:11]1)[CH2:42][CH:43]1[CH2:44][CH2:45][N:46]([C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[CH2:47][CH2:48]1