HRID90474

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID923

Sodium ion

Na+

HCID71081

Oxalic acid, ion(2-)

C2O4-2

HCID166653

Hydride

H-

HCID10797755

1-Methyl-7-methoxy-2-tetralone

C12H14O2

HCID21293877

未命名化合物

PRODUCTS

生成物

HCID971

Oxalic acid

C2H2O4

结构：COc1ccc2c(c1)C(C)(CCNCCc1ccccc1)C(=O)CC2

HCID68133380

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ec025d602d014d59ae2dc5bc9de583a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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