HRID145439

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID338

Salicylic acid

C7H6O3

HCID795

Imidazole

C3H4N2

HCID8857

Ethyl acetate

C4H8O2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID2794257

Benzyl N-(2-aminoethyl)carbamate

C10H14N2O2

PRODUCTS

生成物

HCID59193325

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3801ce1f8bab444587d8bae50ddb1fad
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

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