HRID1130053

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1512535

tert-butyl N-(4-oxocyclohexyl)carbamate

C11H19NO3

结构：O=C(CNC(=O)c1cccc(C(F)(F)F)c1)NC1CNC1

HCID59361594

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCC(N2CC(NC(=O)CNC(=O)c3cccc(C(F)(F)F)c3)C2)CC1

HCID59541119

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-adba18251ef7480688862339f3548b2e
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1)=[O:15].[NH:16]1[CH2:17][CH:18]([NH:20][C:21](=[O:22])[CH2:23][NH:24][C:25]([c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)=[O:36])[CH2:19]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][CH:11]([N:16]2[CH2:17][CH:18]([NH:20][C:21](=[O:22])[CH2:23][NH:24][C:25]([c:26]3[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]3)=[O:36])[CH2:19]2)[CH2:12][CH2:13]1)=[O:15]