HRID1236005

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

结构：CCOC(=O)C(Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1)NC(=O)OC(C)(C)C

HCID21988876

未命名化合物

结构：COC(=O)C(Cc1ccc(O)cc1)(N=C=O)OC(C)(C)C

HCID178499963

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1)NC(=O)OC(C)(C)C

HCID14560583

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6af9c09d166742ae98b23bc5bb9ee676
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]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH2:15][c:16]1[cH:17][cH:18][c:19]([O:22][S:23](=[O:24])(=[O:25])[C:26]([F:27])([F:28])[F:29])[cH:20][cH:21]1.[C:30]([O:31][C:32]([N:33]=[C:34]=[O:35])([CH2:36][c:37]1[cH:38][cH:39][c:40]([OH:41])[cH:42][cH:43]1)[C:44]([O:45][CH3:46])=[O:47])([CH3:48])([CH3:49])[CH3:50].[O-:51][S:52]([C:53]([F:54])([F:55])[F:56])(=[O:57])=[O:58]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[O:12][CH3:13])[CH2:15][c:16]1[cH:17][cH:18][c:19]([O:22][S:23](=[O:24])(=[O:25])[C:26]([F:27])([F:28])[F:29])[cH:20][cH:21]1