HRID1206483

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID10387

Benzyl chloroformate

C8H7ClO2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID2777952

3,4,5-Trifluorophenylacetic acid

C8H5F3O2

PRODUCTS

生成物

HCID86628508

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f643a10bd3324769b880e75fe1c398d9
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

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