HRID688886

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6386

tert-Butyl alcohol

C4H10O

HCID31405

2,6-Di-tert-butylphenol

C14H22O

HCID87118

1-Octadecyl-1H-pyrrole-2,5-dione

C22H39NO2

HCID166653

Hydride

H-

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCCCN1C(=O)CC(c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O

HCID14148376

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ee6a83b705e44f5b25d941684ac570a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[c:8]([OH:17])[c:9]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:10][cH:11][cH:12]1.[C:43]([OH:44])([CH3:45])([CH3:46])[CH3:47].[CH2:18]([CH2:19][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][CH3:35])[N:36]1[C:37](=[O:42])[CH:38]=[CH:39][C:40]1=[O:41].[H-:1].[Na+:2]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[c:8]([OH:17])[c:9]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:10][c:11]([CH:39]2[CH2:38][C:37](=[O:42])[N:36]([CH2:18][CH2:19][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][CH3:35])[C:40]2=[O:41])[cH:12]1