HRID694773

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

HCID285561

(5-Bromopentyl)benzene

C11H15Br

HCID135778511

未命名化合物

PRODUCTS

生成物

结构：COc1cc([N+](=O)[O-])c2nccc(C)c2c1OCCCCCc1ccccc1

HCID19822147

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70a879e50825465fb349e628f34bae4f
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

[Br:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH2:41]1[O:42][CH:43]1[CH3:44].[CH3:30][N:31]([CH3:32])[P:33]([N:34]([CH3:35])[CH3:36])([N:37]([CH3:38])[CH3:39])=[O:40].[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[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][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1