HRID123404

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5463800

6-Hydroxy-1-naphthoic acid

C11H8O3

结构：COc1ccc(C2=NN(C3CCNCC3)C(=O)C2(C)C)cc1OC

HCID66616407

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C2=NN(C3CCN(C(=O)c4cccc5cc(O)ccc45)CC3)C(=O)C2(C)C)cc1OC

HCID67366492

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-693240960bc446f5a69a2d361ae7eac9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10].[OH:25][c:26]1[cH:27][c:28]2[cH:29][cH:30][cH:31][c:32]([C:36](=[O:37])[OH:38])[c:33]2[cH:34][cH:35]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][N:19]([C:36]([c:32]4[cH:31][cH:30][cH:29][c:28]5[cH:27][c:26]([OH:25])[cH:35][cH:34][c:33]54)=[O:37])[CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10]