HRID1146375

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID8028

Tetrahydrofuran

C4H8O

HCID4574913

未命名化合物

HCID22248400

tert-Butyl 4-fluoro-4-(hydroxymethyl)piperidine-1-carboxylate

C11H20FNO3

HCID86657779

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nnc(OCC2(F)CCN(C(=O)OC(C)(C)C)CC2)cc1-c1ccc(OC2CCCCC2)cc1

HCID67374462

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-066588ff38734473a4929c414dfd9240
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](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][OH:15])([F:16])[CH2:12][CH2:13]1.[CH2:23]([CH2:24][CH2:25][CH3:26])[c:27]1[n:28][n:29][c:30]([Cl:46])[cH:31][c:32]1-[c:33]1[cH:34][cH:35][c:36]([O:39][CH:40]2[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]2)[cH:37][cH:38]1.[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:17][C:18]([CH3:19])([O-:20])[CH3:21].[K+:22]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][O:15][c:30]2[n:29][n:28][c:27]([CH2:23][CH2:24][CH2:25][CH3:26])[c:32](-[c:33]3[cH:34][cH:35][c:36]([O:39][CH:40]4[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]4)[cH:37][cH:38]3)[cH:31]2)([F:16])[CH2:12][CH2:13]1