HRID198997

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID34228

4-Pyridineacetic acid

C7H7NO2

HCID178510382

未命名化合物

PRODUCTS

产物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID178510404

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e30bec21638d498991b1a30dcffe5e20
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

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