HRID138394

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID191086

2-(4-Methylphenyl)-1-phenylethan-1-amine

C15H17N

结构：CC12CCC(=O)NC1=CCC1C2CCC2(C)C(C(=O)O)CCC12

HCID22020172

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(CC(NC(=O)C2CCC3C4CC=C5NC(=O)CCC5(C)C4CCC23C)c2ccccc2)cc1

HCID178425139

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a511af46430740249b163a064a9f9ea7
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

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