HRID95400

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID6344

Dichloromethane

CH2Cl2

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID595238

4-Methoxy-1-methyl-1H-indole

C10H11NO

HCID4681724

2-(1,1-Dimethylethyl)-3-methyl-5-(phenylmethyl)-4-imidazolidinone

C15H22N2O

HCID56616610

4-(Benzyloxy)but-2-enal

C11H12O2

PRODUCTS

产物

HCID23496288

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-62db55afd75f46d7b0f4eb0520fc9b13
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

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