HRID810895

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID76646

1-Propanol, 3-(dimethylamino)-

C5H13NO

反应SMILES：COC(=O)c1ccc([N+](=O)[O-])c(O)c1

HCID294866

methyl 3-hydroxy-4-nitrobenzoate

C8H7NO5

PRODUCTS

产物

反应SMILES：COC(=O)c1ccc([N+](=O)[O-])c(OCCCN(C)C)c1

HCID67255056

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5352d383f7614050b44d7b1f36c9dd37
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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