HRID1138407

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID17756

Glycol monopropyl ether

C5H12O2

HCID75555

未命名化合物

结构：COC(=O)c1n[nH]c(C(=O)OC)c1[N+](=O)[O-]

HCID1421248

dimethyl 4-nitro-1H-pyrazole-3,5-dicarboxylate

C7H7N3O6

PRODUCTS

生成物

结构：CCCOCCn1nc(C(=O)OC)c([N+](=O)[O-])c1C(=O)OC

HCID57446147

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dea83dd176ac442c90e21223a803f46c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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