HRID2313795

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID75539

1-Octadecanamine, N-methyl-

C19H41N

HCID20345897

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCCCN(C)C(=O)Cc1c(C)cc(C(C)(C)C)c(O)c1C

HCID20345949

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c4303919f46645758daa9804695588a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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