HRID198033

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3776

Isopropanol

C3H8O

HCID6344

Dichloromethane

CH2Cl2

HCID7914

Isopropyl ether

C6H14O

HCID81531

Diisopropylethylamine

C8H19N

HCID588115

2-(2-NAPHTHYL)ACETYL 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)Cc3ccc4ccccc4c3)CC21

HCID67718980

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-907c464adab6409d9941126a897a9f31
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

[CH3:59][CH:60]([OH:61])[CH3:62].[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[CH:63]([O:64][CH:65]([CH3:66])[CH3:67])([CH3:68])[CH3:69].[Cl:56][CH2:57][Cl:58].[OH2:55].[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.[cH:41]1[c:42]([CH2:51][C:52](=[O:53])[Cl:54])[cH:43][cH:44][c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]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:52]([CH2:51][c:42]4[cH:41][c:50]5[c:45]([cH:44][cH:43]4)[cH:46][cH:47][cH:48][cH:49]5)=[O:53])[CH2:14][CH:15]23)[cH:2][cH:3][cH:4][cH:5][cH:6]1