HRID2316229

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID97792

2,5-Tetrahydrofurandimethanol

C6H12O3

HCID166653

Hydride

H-

HCID319508

Ethyl N-(diphenylmethylidene)glycinate

C17H17NO2

PRODUCTS

生成物

结构：CCOC(=O)C1(N=C(c2ccccc2)c2ccccc2)CC2CCC(C1)O2

HCID54428051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c6a1ac8d4864e6eb431743889c0663b
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

[CH2:3]([CH3:4])[O:5][C:6]([CH2:7][N:8]=[C:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)=[O:22].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[H-:1].[Na+:2].[OH:23][S:24]([c:25]1[cH:26][cH:27][c:28]([CH3:29])[cH:30][cH:31]1)(=[O:32])=[O:33].[OH:34][S:35]([c:36]1[cH:37][cH:38][c:39]([CH3:40])[cH:41][cH:42]1)(=[O:43])=[O:44].[OH:45][CH2:46][CH:47]1[O:48][CH:49]([CH2:52][OH:53])[CH2:50][CH2:51]1>>[CH2:3]([CH3:4])[O:5][C:6]([C:7]1([N:8]=[C:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:46][CH:47]2[O:48][CH:49]([CH2:50][CH2:51]2)[CH2:52]1)=[O:22]