HRID195808

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID96404

Benzaldehyde, 2,6-dimethoxy-

C9H10O3

结构：Nc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID11234297

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(OC)c1CNc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

HCID66913897

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f98ef2a5574b48748fc9febb92f7d9cd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][n:10][c:11]2[c:12]([C:25]([F:26])([F:27])[F:28])[cH:13][cH:14][cH:15][c:16]2[c:17]1-[c:18]1[cH:19][c:20]([NH2:24])[cH:21][cH:22][cH:23]1.[CH3:29][O:30][c:31]1[c:32]([CH:33]=[O:34])[c:35]([O:39][CH3:40])[cH:36][cH:37][cH:38]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][n:10][c:11]2[c:12]([C:25]([F:26])([F:27])[F:28])[cH:13][cH:14][cH:15][c:16]2[c:17]1-[c:18]1[cH:19][c:20]([NH:24][CH2:33][c:32]2[c:31]([O:30][CH3:29])[cH:38][cH:37][cH:36][c:35]2[O:39][CH3:40])[cH:21][cH:22][cH:23]1