HRID2348022

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID8212

Octadecanoyl chloride

C18H35ClO

结构：C=CCC(CO)COC(=O)C(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(C)C

HCID178447159

未命名化合物

PRODUCTS

生成物

结构：C=CCC(COC(=O)C(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(C)C)C(O)C(=O)CCCCCCCCCCCCCCCCC

HCID178447153

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff4b0ae6a2704816a055ef9f43e88d32
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][CH:21]([CH:22]([CH3:23])[CH3:24])[C:25](=[O:26])[O:27][CH2:28][CH:29]([CH2:30][OH:31])[CH2:32][CH:33]=[CH2:34].[C:41]([CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH2:57][CH3:58])(=[O:59])[Cl:60].[Cl:61][CH2:62][Cl:63].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][CH:21]([CH:22]([CH3:23])[CH3:24])[C:25](=[O:26])[O:27][CH2:28][CH:29]([CH:30]([OH:31])[C:41]([CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH2:57][CH3:58])=[O:59])[CH2:32][CH:33]=[CH2:34]