HRID1557831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

结构：COC(=O)c1cc(N2CCOCC2)cc2c1nc(C(F)F)n2Cc1cccc(C(F)(F)F)c1C

HCID66977078

未命名化合物

PRODUCTS

生成物

结构：Cc1c(Cn2c(C(F)F)nc3c(C(=O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F

HCID56960685

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bcb6955b18f0463ebc0f0cfa657d83ac
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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