HRID1213473

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID5210422

1-Cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

C13H9F2NO3

HCID14774638

6,8-Diazabicyclo[3.2.2]nonane

C7H14N2

PRODUCTS

生成物

结构：O=C(O)c1cn(C2CC2)c2cc(N3CC4CCCC3CN4)c(F)cc2c1=O

HCID14774672

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4a861333d53647d4b3a88f3717890601
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

[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([F:14])[cH:12][c:13]23)[CH2:2][CH2:3]1.[CH:20]12[CH2:21][CH2:22][CH2:23][CH:24]([NH:25][CH2:26]1)[CH2:27][NH:28]2.[N:29]12[CH2:30][CH2:31][CH2:32][N:33]=[C:34]1[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2.[cH:40]1[cH:41][cH:42][n:43][cH:44][cH:45]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([N:25]4[CH:24]5[CH2:23][CH2:22][CH2:21][CH:20]([CH2:26]4)[NH:28][CH2:27]5)[cH:12][c:13]23)[CH2:2][CH2:3]1