HRID187504

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：CN1C(=O)CCC2(C)C1=CCC1C2CCC2(C)C(C(=O)O)CCC12

HCID178481385

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(CC(NC(=O)C2CCC3C4CC=C5N(C)C(=O)CCC5(C)C4CCC23C)c2ccccc2)cc1

HCID178425138

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5da28ee0055e4cd0a55edcd02bbfc7fb
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

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