HRID1221765

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID8471

Triethylamine

C6H15N

HCID9845

Trifluoroacetic anhydride

C4F6O3

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1ccccc12

HCID18673579

tert-Butyl 3-oxo-2,3-dihydro-1'H-spiro[indene-1,4'-piperidine]-1'-carboxylate

C18H23NO3

PRODUCTS

生成物

结构：O=C1CC2(CCN(C(=O)C(F)(F)F)CC2)c2ccccc21

HCID19366992

1′-(2,2,2-Trifluoroacetyl)spiro[1H-indene-1,4′-piperidin]-3(2H)-one

C15H14F3NO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d8d11aef3b314972a13056296e821f64
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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