HRID205197

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID5058359

Tert-butyl 3-(hydroxymethyl)morpholine-4-carboxylate

C10H19NO4

结构：O=C(Oc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(F)cc2F)CC1

HCID53396670

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCOCC1COC(=O)N1CCN(c2ccc(F)cc2F)CC1

HCID66934537

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-419bbfc66b8b4d519a4e08f659662d1d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:14][OH:15])[CH2:10][O:11][CH2:12][CH2:13]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[H-:17].[N+:18]([c:19]1[cH:20][cH:21][c:22]([O:27][C:28](=[O:23])[N:30]2[CH2:31][CH2:32][N:33]([c:36]3[c:37]([F:43])[cH:38][c:39]([F:42])[cH:40][cH:41]3)[CH2:34][CH2:35]2)[cH:24][cH:25]1)([O-:26])=[O:29].[Na+:16]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:14][O:15][C:28](=[O:27])[N:30]2[CH2:31][CH2:32][N:33]([c:36]3[c:37]([F:43])[cH:38][c:39]([F:42])[cH:40][cH:41]3)[CH2:34][CH2:35]2)[CH2:10][O:11][CH2:12][CH2:13]1