HRID1149124

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7468

4-Aminoacetophenone

C8H9NO

HCID8471

Triethylamine

C6H15N

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID10515816

2-(Benzyl(tert-butoxycarbonyl)amino)acetic acid

C14H19NO4

PRODUCTS

生成物

结构：CC(=O)c1ccc(NC(=O)CN(Cc2ccccc2)C(=O)OC(C)(C)C)cc1

HCID18369528

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0ee0789409b74821876d15909e676000
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:1][C:2]([O:3][CH2:4][CH:5]([CH3:6])[CH3:7])=[O:8].[Cl:45][CH2:46][Cl:47].[NH2:35][c:36]1[cH:37][cH:38][c:39]([C:42]([CH3:43])=[O:44])[cH:40][cH:41]1.[OH2:48].[OH:9][C:10]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27]>>[C:10]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)(=[O:27])[NH:35][c:36]1[cH:37][cH:38][c:39]([C:42]([CH3:43])=[O:44])[cH:40][cH:41]1