HRID180238

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1183

4-Hydroxy-3-methoxybenzaldehyde

C8H8O3

HCID10540773

2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethyl methanesulfonate

C13H15NO4S

结构：COc1cc(C=O)ccc1OCCc1nc(-c2ccccc2)oc1C

HCID18003585

未命名化合物

HCID21920117

未命名化合物

PRODUCTS

生成物

结构：CCOC(C(=O)N1C(=O)OCC1Cc1ccccc1)C(O)c1ccc(OCCc2nc(-c3ccccc3)oc2C)c(OC)c1

HCID178468062

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fe88837c24994653a70c9290a48b6f12
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:56]([c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)[CH:63]1[N:64]([C:69]([CH2:70][O:71][CH2:72][CH3:73])=[O:74])[C:65](=[O:68])[O:66][CH2:67]1.[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9][c:10]1[O:11][CH2:12][CH2:13][c:14]1[n:15][c:16](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[o:17][c:18]1[CH3:19].[CH3:37][c:38]1[o:39][c:40](-[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[n:47][c:48]1[CH2:49][CH2:50][O:51][S:52]([CH3:53])(=[O:54])=[O:55].[OH:26][c:27]1[cH:28][cH:29][c:30]([CH:31]=[O:32])[cH:33][c:34]1[O:35][CH3:36]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]([OH:7])[CH:70]([C:69]([N:64]2[CH:63]([CH2:56][c:57]3[cH:58][cH:59][cH:60][cH:61][cH:62]3)[CH2:67][O:66][C:65]2=[O:68])=[O:74])[O:71][CH2:72][CH3:73])[cH:8][cH:9][c:10]1[O:11][CH2:12][CH2:13][c:14]1[n:15][c:16](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[o:17][c:18]1[CH3:19]