HRID203821

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID15307

3-Octenoic acid

C8H14O2

HCID19017092

未命名化合物

PRODUCTS

生成物

结构：CCCCC=CCC(=O)Oc1ccc(-c2ccc(CCCCCOCCC)cc2)nc1

HCID54206810

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-179381e7c2d84d6ebc99407886a06160
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

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