查数据/反应详情

HRID950537

反应详情

EQUATION

反应方程式

HRID 950537 的结构方程式

REACTANTS

反应物

2

结构：Cc1ccc(O)c(C(=O)O)c1

5-Methylsalicylic acid

C8H8O3

结构：CC(C)(C)c1ccc(C(C)(C)C)c(N)c1

2,5-di-tert-Butylaniline

C14H23N

PRODUCTS

生成物

1

结构：Cc1ccc(O)c(C(=O)Nc2cc(C(C)(C)C)ccc2C(C)(C)C)c1

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-21c327e60dd24650a8830a5e0d4e74e6
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:12][C:13]([CH3:14])([CH3:15])[c:16]1[c:17]([NH2:18])[cH:19][c:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:21][cH:22]1.[CH3:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:8])[OH:9])[cH:10]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([OH:11])[c:6]([C:7](=[O:9])[NH:18][c:17]2[c:16]([C:13]([CH3:12])([CH3:14])[CH3:15])[cH:22][cH:21][c:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:19]2)[cH:10]1

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