HRID320815

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID357785

3-Bromo-2-methylpropene

C4H7Br

HCID3280088

未命名化合物

结构：O=C(Cc1cc(OCc2ccccc2)cc(-c2ccc(C(F)(F)F)cc2)c1)N1C(=O)OCC1Cc1ccccc1

HCID66698236

未命名化合物

PRODUCTS

生成物

结构：C=C(C)CC(C(=O)N1C(=O)OCC1Cc1ccccc1)c1cc(OCc2ccccc2)cc(-c2ccc(C(F)(F)F)cc2)c1

HCID66698264

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ceaa37fb0f96460daeedaacb848e64c3
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

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