HRID667973

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID119882

2-{[4-(Benzyloxy)phenoxy]methyl}oxirane

C16H16O3

结构：CC(COc1ccc2c(c1)C(=O)NC(C)(C)O2)NCc1ccccc1

HCID13754414

未命名化合物

PRODUCTS

生成物

结构：CC(COc1ccc2c(c1)C(=O)NC(C)(C)O2)N(Cc1ccccc1)CC(O)COc1ccc(OCc2ccccc2)cc1

HCID13754411

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-61d24d7bbb184b7089fb00e4fe24e0c7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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