HRID294432

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID11776

Triphenylphosphine

C18H15P

HCID33558

Azide

N3-

2 次

结构：CC(C)(C)C=Cc1cccc2c1OC(CN=[N+]=[N-])C2

HCID90934411

未命名化合物

结构：Cc1ccc(S(=O)(=O)OCC2Cc3cccc(C=CC(C)(C)C)c3O2)cc1

HCID91138573

未命名化合物

PRODUCTS

生成物

HCID68961709

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca6da2cba250478a8cde6ad6c0dffb52
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

[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:8][CH:9]2[CH2:10][c:11]3[cH:12][cH:13][cH:14][c:15]([CH:16]=[CH:17][C:18]([CH3:19])([CH3:20])[CH3:21])[c:22]3[O:23]2)(=[O:24])=[O:25])[cH:26][cH:27]1.[CH3:32][C:33]([CH:34]=[CH:35][c:36]1[cH:37][cH:38][cH:39][c:40]2[c:44]1[O:43][CH:42]([CH2:45][N:46]=[N+:47]=[N-:48])[CH2:41]2)([CH3:49])[CH3:50].[ClH:73].[N-:29]=[N+:30]=[N-:31].[N-:51]=[N+:52]=[N-:53].[Na+:28].[c:54]1([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[cH:68][cH:69][cH:70][cH:71][cH:72]1>>[CH3:32][C:33]([CH:34]=[CH:35][c:36]1[cH:37][cH:38][cH:39][c:40]2[c:44]1[O:43][CH:42]([CH2:45][NH2:46])[CH2:41]2)([CH3:49])[CH3:50]