HRID183299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7726

4-Chlorobenzaldehyde

C7H5ClO

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID9845

Trifluoroacetic anhydride

C4F6O3

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID137080

3(2H)-Furanone, 2,2,5-trimethyl-

C7H10O2

HCID178418339

未命名化合物

PRODUCTS

生成物

HCID53904971

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8522ab1327da4632bdee8c298c6a2b04
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

[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:13][C:14]1([CH3:21])[O:15][C:16]([CH3:20])=[CH:17][C:18]1=[O:19].[CH3:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH3:62][N:63]([P:64]([N:65]([CH3:66])[CH3:67])([N:68]([CH3:69])[CH3:70])=[O:71])[CH3:72].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl:22][c:23]1[cH:24][cH:25][c:26]([CH:27]=[O:28])[cH:29][cH:30]1.[F:31][C:32]([F:33])([F:34])[C:35]([O:36][C:37](=[O:38])[C:39]([F:40])([F:41])[F:42])=[O:43].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[CH3:13][C:14]1([CH3:21])[O:15][C:16]([CH:20]=[CH:27][c:26]2[cH:25][cH:24][c:23]([Cl:22])[cH:30][cH:29]2)=[CH:17][C:18]1=[O:19]