HRID2157655

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

2 次

HCID10268

3-Furoic acid

C5H4O3

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

HCID21090583

Methyl 5′-amino-2′-methyl[1,1′-biphenyl]-4-carboxylate

C15H15NO2

结构：COC(=O)c1ccc(-c2cc(NC(=O)c3ccoc3)ccc2C)cc1

HCID69152621

未命名化合物

PRODUCTS

生成物

HCID69152621

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-deb0d111da8147c9a3f205c979c41687
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH:100]([N:101]([CH2:102][CH3:103])[CH:104]([CH3:105])[CH3:106])([CH3:107])[CH3:108].[NH2:82][c:83]1[cH:84][cH:85][c:86]([CH3:87])[c:88](-[c:89]2[cH:90][cH:91][c:92]([C:93]([O:94][CH3:95])=[O:96])[cH:97][cH:98]2)[cH:99]1.[O:109]=[CH:110][N:111]([CH3:112])[CH3:113].[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[P-:58]([F:59])([F:60])([F:61])([F:62])([F:63])[F:64].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[n:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1.[n:65]1([O:66][C:67]([N:68]([CH3:69])[CH3:70])=[N+:71]([CH3:72])[CH3:73])[c:74]2[cH:75][cH:76][cH:77][cH:78][c:79]2[n:80][n:81]1.[o:1]1[cH:2][c:3]([C:6](=[O:7])[OH:8])[cH:4][cH:5]1.[o:9]1[cH:10][cH:11][c:12]([C:13](=[O:14])[NH:16][c:17]2[cH:18][cH:19][c:20]([CH3:33])[c:21](-[c:23]3[cH:24][cH:25][c:26]([C:29](=[O:30])[O:31][CH3:32])[cH:27][cH:28]3)[cH:22]2)[cH:15]1>>[o:1]1[cH:2][c:3]([C:6](=[O:8])[NH:16][c:17]2[cH:18][cH:19][c:20]([CH3:33])[c:21](-[c:23]3[cH:24][cH:25][c:26]([C:29](=[O:30])[O:31][CH3:32])[cH:27][cH:28]3)[cH:22]2)[cH:4][cH:5]1