HRID112882

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

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

HCID22911441

未命名化合物

PRODUCTS

生成物

结构：O=C(O)c1cn(C2CC2)c2c(F)c(N3CC(CO)C(C(F)(F)F)C3)c(F)cc2c1=O

HCID22911437

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1550e14e10a24a909e2780202f0c4c34
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][S:41]([CH3:42])=[O:43].[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].[OH:22][CH2:23][CH:24]1[CH2:25][NH:26][CH2:27][CH:28]1[C:29]([F:30])([F:31])[F:32]>>[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:26]4[CH2:25][CH:24]([CH2:23][OH:22])[CH:28]([C:29]([F:30])([F:31])[F:32])[CH2:27]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1