HRID1241176

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6378

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

C3H6O

HCID8471

Triethylamine

C6H15N

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID2735603

1-Bromo-7-phenylheptane

C13H19Br

HCID135778511

未命名化合物

PRODUCTS

生成物

结构：COc1cc([N+](=O)[O-])c2nccc(C)c2c1OCCCCCCCc1ccccc1

HCID616385

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7816a905b7c9441fb8bcd252c07bc189
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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