HRID670154

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

结构：CCOC(=O)c1ccc(CC(c2ccc([N+](=O)[O-])cc2)C(C)N=[N+]=[N-])o1

HCID54125754

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ccc(CC(c2ccc([N+](=O)[O-])cc2)C(C)N)o1

HCID53734556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d023bd0844ea4656a20c10526fdecde0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:46]([O:47][CH2:48][CH3:49])[CH3:50].[N:1](=[N+:2]=[N-:3])[CH:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[o:11]1)[c:17]1[cH:18][cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]1)[CH3:26].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH2:56].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[NH2:1][CH:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[o:11]1)[c:17]1[cH:18][cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]1)[CH3:26]