HRID192826

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

结构：COC(=O)c1ccc(Oc2ccc(C(Cc3ccncc3)c3ccc(OC(F)F)c(OC(F)F)c3)cn2)cc1

HCID21262791

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Oc2ccc(C(Cc3cc[n+]([O-])cc3)c3ccc(OC(F)F)c(OC(F)F)c3)cn2)cc1

HCID21262785

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b73a8337ecec4f0191cd8a945d80d001
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

[CH3:40][OH:41].[Cl:42][CH2:43][Cl:44].[F:1][CH:2]([O:3][c:4]1[cH:5][c:6]([CH:14]([CH2:15][c:16]2[cH:17][cH:18][n:19][cH:20][cH:21]2)[c:22]2[cH:23][n:24][c:25]([O:28][c:29]3[cH:30][cH:31][c:32]([C:35](=[O:36])[O:37][CH3:38])[cH:33][cH:34]3)[cH:26][cH:27]2)[cH:7][cH:8][c:9]1[O:10][CH:11]([F:12])[F:13])[F:39]>>[F:1][CH:2]([O:3][c:4]1[cH:5][c:6]([CH:14]([CH2:15][c:16]2[cH:17][cH:18][n+:19]([O-:41])[cH:20][cH:21]2)[c:22]2[cH:23][n:24][c:25]([O:28][c:29]3[cH:30][cH:31][c:32]([C:35](=[O:36])[O:37][CH3:38])[cH:33][cH:34]3)[cH:26][cH:27]2)[cH:7][cH:8][c:9]1[O:10][CH:11]([F:12])[F:13])[F:39]