HRID296284

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID962

Water

H2O

HCID7449

3-Nitrobenzaldehyde

C7H5NO3

HCID8028

Tetrahydrofuran

C4H8O

HCID2826723

azanide

H2N-

HCID5360545

Sodium

结构：CCOC(=O)CCCCCCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID19063385

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCCCCCCCCC=Cc1cccc([N+](=O)[O-])c1

HCID53714556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5b686b93cb08420896825a3f0242d0f9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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