HRID147094

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID68028

3,3,3-Trifluoropropanal

C3H3F3O

HCID2724942

未命名化合物

HCID10562199

tert-Butyl 4-amino-4-carbamoylpiperidine-1-carboxylate

C11H21N3O3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(NCCC(F)(F)F)(C(N)=O)CC1

HCID86656052

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-806413317d3643fe9464b6ed3c695275
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:25]([O:26][BH-:27]([O:28][C:29](=[O:30])[CH3:31])[O:32][C:33](=[O:34])[CH3:35])(=[O:36])[CH3:37].[CH3:39][C:40](=[O:41])[OH:42].[Cl:44][CH2:45][Cl:46].[F:18][C:19]([CH2:20][CH:21]=[O:22])([F:23])[F:24].[NH2:1][C:2]1([C:15]([NH2:16])=[O:17])[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1.[Na+:38].[OH2:43]>>[NH:1]([C:2]1([C:15]([NH2:16])=[O:17])[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1)[CH2:21][CH2:20][C:19]([F:18])([F:23])[F:24]