HRID2149451

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID92898

2-Chloro-1-phenylethan-1-ol

C8H9ClO

HCID10855403

1-Propanol, 3-chloro-2-methyl-

C4H9ClO

HCID16757255

2-methyl-N-[3-(4-piperidyl)phenyl]propanamide

C15H22N2O

结构：CC(CO)CN1CCC(c2cccc(NC(=O)C(C)C)c2)CC1

HCID22049235

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(=O)Nc1cccc(C2CCN(CC(O)c3ccccc3)CC2)c1

HCID22048667

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e8f23546250142edac34451613f3972e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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