HRID1575633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(OC(=N)C(Cl)(Cl)Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID73028875

未命名化合物

结构：CCOC(=O)C1CCC(O)C(c2ccc(F)cc2)C1C(=O)OCC

HCID74834004

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1CCC(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(c2ccc(F)cc2)C1C(=O)OCC

HCID74834005

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7575be0c23d4e39b2b5afac51185bb9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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