HRID1143174

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID62325

2-Methylpropanoyl chloride

C4H7ClO

结构：COCC(C)(COC)CN(CCF)CCCN(C)CCC1(O)CCc2cc(F)ccc2C1C(C)C

HCID178495080

未命名化合物

PRODUCTS

生成物

结构：COCC(C)(COC)CN(CCF)CCCN(C)CCC1(OC(=O)C(C)C)CCc2cc(F)ccc2C1C(C)C

HCID75114258

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9407c5f68c484c928c32e35b4134ac51
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:36]([CH:37]([CH3:38])[CH3:39])(=[O:40])[Cl:41].[Cl:42][CH2:43][Cl:44].[F:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[CH:8]([CH:12]([CH3:13])[CH3:14])[C:7]([OH:15])([CH2:16][CH2:17][N:18]([CH3:19])[CH2:20][CH2:21][CH2:22][N:23]([CH2:24][C:25]([CH2:26][O:27][CH3:28])([CH3:29])[CH2:30][O:31][CH3:32])[CH2:33][CH2:34][F:35])[CH2:6][CH2:5]2>>[F:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[CH:8]([CH:12]([CH3:13])[CH3:14])[C:7]([O:15][C:36]([CH:37]([CH3:38])[CH3:39])=[O:40])([CH2:16][CH2:17][N:18]([CH3:19])[CH2:20][CH2:21][CH2:22][N:23]([CH2:24][C:25]([CH2:26][O:27][CH3:28])([CH3:29])[CH2:30][O:31][CH3:32])[CH2:33][CH2:34][F:35])[CH2:6][CH2:5]2