HRID173056

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID166653

Hydride

H-

结构：BrCc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID10053461

5-[4'-(Bromomethyl)[1,1'-biphenyl]-2-yl]-1-(triphenylmethyl)-1H-tetrazole

C33H25BrN4

HCID178441635

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nc(C(C)(C)O)c(C(=O)OCC)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID19036123

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49e20ee5bfa94a30b84dca37a4734ddf
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

[C:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)([c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[n:40]1[n:41][n:42][n:43][c:44]1-[c:45]1[c:46](-[c:51]2[cH:52][cH:53][c:54]([CH2:55][Br:56])[cH:57][cH:58]2)[cH:47][cH:48][cH:49][cH:50]1.[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[nH:6][c:7]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:8]([C:10]([CH3:11])([CH3:12])[OH:13])[n:9]1.[H-:19].[Na+:20]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:55][c:54]2[cH:53][cH:52][c:51](-[c:46]3[c:45](-[c:44]4[n:40]([C:21]([c:22]5[cH:23][cH:24][cH:25][cH:26][cH:27]5)([c:28]5[cH:29][cH:30][cH:31][cH:32][cH:33]5)[c:34]5[cH:35][cH:36][cH:37][cH:38][cH:39]5)[n:41][n:42][n:43]4)[cH:50][cH:49][cH:48][cH:47]3)[cH:58][cH:57]2)[c:7]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:8]([C:10]([CH3:11])([CH3:12])[OH:13])[n:9]1