HRID300451

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：COc1cc2c(=O)n(COC(=O)C(C)(C)C)cnc2cc1O

HCID10804576

(7-Hydroxy-6-methoxy-4-oxoquinazolin-3(4H)-yl)methyl pivalate

C15H18N2O5

结构：Cc1ccc(S(=O)(=O)OCCC2CCN(C(=O)OC(C)(C)C)CC2)cc1

HCID21936070

tert-Butyl 4-{2-[(4-methylbenzene-1-sulfonyl)oxy]ethyl}piperidine-1-carboxylate

C19H29NO5S

PRODUCTS

生成物

结构：COc1cc2c(=O)n(COC(=O)C(C)(C)C)cnc2cc1OCCC1CCN(C(=O)OC(C)(C)C)CC1

HCID11027693

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-caf751779d4c4b4d98bba5b6fac15007
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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