HRID2128268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID12052

Silane, triethyl-

C6H16Si

HCID61778

Bisulfate anion

HO4S-

反应SMILES：COC(=O)CC(O)CN(CC(OC)OC)C(=O)C(C)Nc1ccc(C(F)(F)F)c(Cl)c1

HCID67074925

未命名化合物

PRODUCTS

产物

反应SMILES：COC(=O)CC(O)CN1CCN(c2ccc(C(F)(F)F)c(Cl)c2)C(C)C1=O

HCID67087028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-af9661fbccbe4b19937e5a0ede855459
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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