HRID1211203

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID112414

Ethanamine, 2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]-

C15H33NO6

HCID3826051

未命名化合物

结构：CCC(CC)c1cc(C)nn2c(-c3sc4ccc(F)cc4c3C)c(C)nc12

HCID57752599

未命名化合物

PRODUCTS

生成物

结构：CCC(CC)c1cc(C)nn2c(-c3sc4ccc(OC)cc4c3C)c(C)nc12

HCID57752684

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a0d4a0760aec4ecd8f6483e6be0473c2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:26]([CH3:27])[CH:28]([CH2:29][CH3:30])[c:31]1[c:32]2[n:33]([n:34][c:35]([CH3:37])[cH:36]1)[c:38](-[c:42]1[c:43]([CH3:52])[c:44]3[c:45]([s:46]1)[cH:47][cH:48][c:49]([F:51])[cH:50]3)[c:39]([CH3:41])[n:40]2.[CH3:1][O-:2].[CH3:4][O:5][CH2:6][CH2:7][O:8][CH2:9][CH2:10][N:11]([CH2:12][CH2:13][O:14][CH2:15][CH2:16][O:17][CH3:18])[CH2:19][CH2:20][O:21][CH2:22][CH2:23][O:24][CH3:25].[Cl:53][CH2:54][Cl:55].[K+:3].[OH2:56]>>[CH3:4][O:5][c:49]1[cH:48][cH:47][c:45]2[c:44]([c:43]([CH3:52])[c:42](-[c:38]3[n:33]4[c:32]([c:31]([CH:28]([CH2:26][CH3:27])[CH2:29][CH3:30])[cH:36][c:35]([CH3:37])[n:34]4)[n:40][c:39]3[CH3:41])[s:46]2)[cH:50]1