HRID810672

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6371

Phosgene

CCl2O

HCID7937

2,6-Dimethylpyridine

C7H9N

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID15609072

2(3H)-Furanone, 4-ethyldihydro-3-hydroxy-4-methyl-

C7H12O3

HCID178446636

未命名化合物

PRODUCTS

生成物

结构：CCCCC(NC(=O)OC1C(=O)OCC1(C)CC)C(O)C(=O)NC(C)c1ccccc1

HCID178446700

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e95a9d426f9e4d9692d1ec9e2de5eeec
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:1]([CH3:2])[C:3]1([CH3:10])[CH:4]([OH:9])[C:5](=[O:8])[O:6][CH2:7]1.[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[Cl:19][C:20]([Cl:21])=[O:22].[NH2:23][CH:24]([CH:25]([C:26](=[O:27])[NH:28][CH:29]([CH3:30])[c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[OH:37])[CH2:38][CH2:39][CH2:40][CH3:41].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[n:11]1[c:12]([CH3:13])[cH:14][cH:15][cH:16][c:17]1[CH3:18]>>[CH2:1]([CH3:2])[C:3]1([CH3:10])[CH:4]([O:9][C:20](=[O:22])[NH:23][CH:24]([CH:25]([C:26](=[O:27])[NH:28][CH:29]([CH3:30])[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[OH:37])[CH2:38][CH2:39][CH2:40][CH3:41])[C:5](=[O:8])[O:6][CH2:7]1