HRID144115

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID10296

(+/-)-2-Phenylpropionic acid

C9H10O2

HCID16757468

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)C(C)C)cc1C1CCN(CCCNC(=O)C(C)c2ccccc2)CC1

HCID18446842

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-33f29079fc1b4f8d82216f7b4e3e65a7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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