HRID1205223

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID735900

1-Boc-4-piperidone

C10H17NO3

HCID10727403

1-(4-bromo-2-hydroxyphenyl)ethanone

C8H7BrO2

结构：COC(=O)C=Cc1ccc2c(c1)C(=O)CC1(CCNCC1)O2

HCID66932212

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1ccc(Br)cc1O2

HCID27281806

tert-Butyl 7-bromo-4-oxo-3,4-dihydro-1'H-spiro[1-benzopyran-2,4'-piperidine]-1'-carboxylate

C18H22BrNO4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0cd8c1f4bb0e40b4ac273d0fe01bab9c
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

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