HRID1114635

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID4233041

3-Boc-aminopiperidine

C10H20N2O2

结构：O=C(Nc1c[nH]c2ncc(C(F)(F)F)c(Cl)c12)c1cnccn1

HCID60205416

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCCN(c2c(C(F)(F)F)cnc3[nH]cc(NC(=O)c4cnccn4)c23)C1

HCID60205417

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab978233efc842778efbaccaaadf02fa
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

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