HRID1132318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2795386

2-(1-Naphthyl)Ethanoyl Chloride

C12H9ClO

结构：COc1ccccc1C1(O)C(O)CC(c2ccccc2)(c2ccccc2)C2CNCC21

HCID19047650

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C1(O)C(O)CC(c2ccccc2)(c2ccccc2)C2CN(C(=O)Cc3cccc4ccccc34)CC21

HCID67719299

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b6b3d6d39a34d4f990a166e23d64afa
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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