HRID124268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID9835941

8-Chloro-1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

C13H8ClF2NO3

HCID15859786

未命名化合物

PRODUCTS

产物

HCID15859790

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6262726cf8eb45f09ba01a1bcc174e3a
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

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