HRID664536

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID7918

Acetic anhydride

C4H6O3

HCID136911

3-Phenyloxolane-2,5-dione

C10H8O3

结构：Cc1ccc(C2c3c(C)c(N)c(C)c(C)c3OC2(C)C)cc1

HCID10685309

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C2c3c(C)c(N4C(=O)CC(c5ccccc5)C4=O)c(C)c(C)c3OC2(C)C)cc1

HCID10204445

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-677bb75d977a434c86494b832c940e91
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

[CH3:1][C:2]1([CH3:22])[O:3][c:4]2[c:5]([c:14]([CH3:21])[c:15]([NH2:20])[c:16]([CH3:19])[c:17]2[CH3:18])[CH:6]1[c:7]1[cH:8][cH:9][c:10]([CH3:13])[cH:11][cH:12]1.[CH3:37][C:38](=[O:39])[O-:40].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH3:48][C:49]([O:50][C:51](=[O:52])[CH3:53])=[O:54].[Na+:36].[c:23]1([CH:29]2[C:30](=[O:31])[O:32][C:33](=[O:35])[CH2:34]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[CH3:1][C:2]1([CH3:22])[O:3][c:4]2[c:5]([c:14]([CH3:21])[c:15]([N:20]3[C:30](=[O:31])[CH:29]([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[CH2:34][C:33]3=[O:32])[c:16]([CH3:19])[c:17]2[CH3:18])[CH:6]1[c:7]1[cH:8][cH:9][c:10]([CH3:13])[cH:11][cH:12]1