HRID90642

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID6344

Dichloromethane

CH2Cl2

HCID8300

2-Methoxyprop-1-ene

C4H8O

结构：COc1ccc(COC2CC(C(O)C(Cc3cc(F)cc(F)c3)NC(C)=O)N(C(=O)OC(C)(C)C)C2)cc1

HCID178491296

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(COC2CC(C3OC(C)(C)N(C(C)=O)C3Cc3cc(F)cc(F)c3)N(C(=O)OC(C)(C)C)C2)cc1

HCID178491278

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d7071f2deb0f48d4ae9a75819683e369
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH:23]([CH:24]([CH2:25][c:26]2[cH:27][c:28]([F:33])[cH:29][c:30]([F:32])[cH:31]2)[NH:34][C:35]([CH3:36])=[O:37])[OH:38])[CH2:10][CH:11]([O:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:12]1.[CH3:39][C:40]([CH3:41])=[O:42].[CH3:43][O:44][C:45]([CH3:46])=[CH2:47].[Cl:48][CH2:49][Cl:50]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH:23]2[CH:24]([CH2:25][c:26]3[cH:27][c:28]([F:33])[cH:29][c:30]([F:32])[cH:31]3)[N:34]([C:35]([CH3:36])=[O:37])[C:40]([CH3:39])([CH3:41])[O:38]2)[CH2:10][CH:11]([O:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:12]1