HRID292958

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID949

N,N-Dimethylaniline

C8H11N

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID3485182

Cyclopentylacetyl chloride

C7H11ClO

结构：CCC1CC2C3CCC4=CC(=O)CCC4C3CCC2(C)C1OC(=O)CO

HCID178435318

未命名化合物

PRODUCTS

生成物

结构：CCC1CC2C3CCC4=CC(=O)CCC4C3CCC2(C)C1OC(=O)COC(=O)CC1CCCC1

HCID178435323

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4956091b19d43739c17713b9982c924
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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