HRID318249

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID2733180

未命名化合物

HCID22397434

未命名化合物

HCID22397508

6-Fluoroimidazo[1,2-a]pyridine-2-carboxylic acid

C8H5FN2O2

PRODUCTS

生成物

结构：O=C(c1cn2cc(F)ccc2n1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

HCID22397486

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1385c098dd614a00b7a1a2fe616c16cf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:29][P+:30]([N:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1)([N:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1)[N:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[CH3:67][CH2:68][N:69]([CH2:70][CH3:71])[CH2:72][CH3:73].[Cl:1][c:2]1[cH:3][c:4]([O:5][CH:6]2[CH2:7][CH2:8][N:9]([CH:12]3[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[cH:18][cH:19][c:20]1[Cl:21].[Cl:64][CH2:65][Cl:66].[F:46][c:47]1[cH:48][cH:49][c:50]2[n:51]([cH:52]1)[cH:53][c:54]([C:56](=[O:57])[OH:58])[n:55]2.[Na+:63].[O-:59][C:60]([OH:61])=[O:62].[P-:22]([F:23])([F:24])([F:25])([F:26])([F:27])[F:28]>>[Cl:1][c:2]1[cH:3][c:4]([O:5][CH:6]2[CH2:7][CH2:8][N:9]([CH:12]3[CH2:13][CH2:14][N:15]([C:56]([c:54]4[cH:53][n:51]5[c:50]([cH:49][cH:48][c:47]([F:46])[cH:52]5)[n:55]4)=[O:57])[CH2:16][CH2:17]3)[CH2:10][CH2:11]2)[cH:18][cH:19][c:20]1[Cl:21]