HRID1557030

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID735736

Tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate

C11H22N2O3

HCID11240684

METHYL 4-HYDROXY-3-METHYLBENZOATE

C9H10O3

PRODUCTS

生成物

结构：COC(=O)c1ccc(OCCN2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1

HCID57555264

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d81d1c4ab61c47cd94b9142f055b9384
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][OH:16])[CH2:12][CH2:13]1.[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:48][O:49][C:50]([c:51]1[cH:52][c:53]([CH3:58])[c:54]([OH:57])[cH:55][cH:56]1)=[O:59].[O:36]=[C:37]([O:38][CH2:39][CH3:40])[N:41]=[N:42][C:43]([O:44][CH2:45][CH3:46])=[O:47].[c:17]1([P:18]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][O:16][c:54]2[c:53]([CH3:58])[cH:52][c:51]([C:50]([O:49][CH3:48])=[O:59])[cH:56][cH:55]2)[CH2:12][CH2:13]1