HRID1125949

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID6228

Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID95463

2(3H)-Furanone, 3-bromodihydro-

C4H5BrO2

HCID102533

DL-Phenylalanine benzyl ester

C16H17NO2

PRODUCTS

产物

反应SMILES：O=C1OCCC1NC(Cc1ccccc1)C(=O)OCc1ccccc1

HCID178519084

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-58911a4762814db4b2667752d09f2c34
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

[Br:31][CH:32]1[C:33](=[O:34])[O:35][CH2:36][CH2:37]1.[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH2:22])[CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[OH2:45].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH:22][CH:32]1[C:33](=[O:34])[O:35][CH2:36][CH2:37]1)[CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30]