HRID153823

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID11776

Triphenylphosphine

C18H15P

HCID22819

(+/-)-1-Indanol

C9H10O

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

结构：CC(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(Br)c1

HCID178465741

未命名化合物

PRODUCTS

生成物

结构：CC(c1cccc(Br)c1)N(C1CCc2ccccc21)S(=O)(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

HCID178435896

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d1fc50701644c7690da01afb25d5b77
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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