HRID205714

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID8471

Triethylamine

C6H15N

结构：O=C(O)c1cn(C2CC2)c2c(F)c(F)c(F)cc2c1=O

HCID535414

1-CYCLOPROPYL-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLIC ACID

C13H8F3NO3

HCID20087920

未命名化合物

PRODUCTS

生成物

结构：CC1(NC(=O)C(F)(F)F)CN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)C1

HCID23051782

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ed7885a720f497bbfeaf56d8b627055
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:22][C:23]1([NH:27][C:28]([C:29]([F:30])([F:31])[F:32])=[O:33])[CH2:24][NH:25][CH2:26]1.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[ClH:21].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([N:25]4[CH2:24][C:23]([CH3:22])([NH:27][C:28]([C:29]([F:30])([F:31])[F:32])=[O:33])[CH2:26]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1