HRID2341783

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID15087784

tert-Butyl 2-methylpiperazine-1-carboxylate

C10H20N2O2

HCID71445696

Diethyl (4-formyl-3-methoxyphenyl)propanedioate

C15H18O6

结构：CC1CN(Cc2ccc(Br)cc2)CCN1C(=O)OCc1ccccc1

HCID178430237

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C(=O)OCC)c1ccc(CN2CCN(C(=O)OC(C)(C)C)C(C)C2)c(OC)c1

HCID178472260

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-488a5091ba124e6fa6e7492e1093cd56
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

[Br:36][c:37]1[cH:38][cH:39][c:40]([CH2:41][N:42]2[CH2:43][CH2:44][N:45]([C:46]([O:47][CH2:48][c:49]3[cH:50][cH:51][cH:52][cH:53][cH:54]3)=[O:55])[CH:56]([CH3:57])[CH2:58]2)[cH:59][cH:60]1.[CH3:22][CH:23]1[N:24]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:25][CH2:26][NH:27][CH2:28]1.[CH:1](=[O:2])[c:3]1[c:4]([O:20][CH3:21])[cH:5][c:6]([CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:7][cH:8]1>>[CH2:1]([c:3]1[c:4]([O:20][CH3:21])[cH:5][c:6]([CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:7][cH:8]1)[N:27]1[CH2:26][CH2:25][N:24]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH:23]([CH3:22])[CH2:28]1