HRID181798

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6378

(+/-)-1,2-Propylene oxide

C3H6O

HCID9237

1,4-Diazabicyclo[2.2.2]octane

C6H12N2

结构：COc1ccccc1COCCCOc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2OCCOc2ccccc2CO)cc1

HCID68501214

Tert-butyl 3-[2-(2-hydroxymethylphenoxy)ethoxy]-4-{4-[3-(2-methoxybenzyloxy)propoxy]phenyl}piperidine-1-carboxylate

C36H47NO8

PRODUCTS

生成物

结构：COc1ccccc1COCCCOc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2OCCOc2ccccc2COCC(C)O)cc1

HCID68499007

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-018b1cfdf8a945bb9286911471c8e4eb
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

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