HRID808806

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

结构：O=C(O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

HCID24811740

2-Fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoic acid

C16H11FN2O3

HCID43167824

未命名化合物

PRODUCTS

生成物

结构：O=C(c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCC(OCCN2CCCC2)CC1

HCID57791843

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a9a22eea23304bdf9f253579f6007884
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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