HRID1202075

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID947

Nitrogen

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID69460

1,2,3,4-Tetrahydroquinoline

C9H11N

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21

HCID636044

1,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)

C39H32OP2

HCID817694

3-Bromo-2-cyanopyridine

C6H3BrN2

PRODUCTS

生成物

HCID67271579

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b98e338c3acd407e925d9f59cc8d7783
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:9][c:10]1[c:11]([C:16]#[N:17])[n:12][cH:13][cH:14][cH:15]1.[C:3](=[O:4])([O-:5])[O-:6].[CH2:18]1[CH2:19][NH:20][c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2[CH2:27]1.[CH3:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[Cs+:7].[Cs+:8].[N:1]#[N:2].[c:28]1([P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[c:37]3[c:61]([cH:62][cH:63][cH:64]2)[C:58]([CH3:59])([CH3:60])[c:40]2[c:39]([c:44]([P:45]([c:46]4[cH:47][cH:48][cH:49][cH:50][cH:51]4)[c:52]4[cH:53][cH:54][cH:55][cH:56][cH:57]4)[cH:43][cH:42][cH:41]2)[O:38]3)[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[c:10]1([N:20]2[CH2:19][CH2:18][CH2:27][c:26]3[c:21]2[cH:22][cH:23][cH:24][cH:25]3)[c:11]([C:16]#[N:17])[n:12][cH:13][cH:14][cH:15]1