HRID1547336

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID30333

2-(Naphthalen-2-yl)oxirane

C12H10O

HCID6454366

2-(Naphthalen-1-yl)oxirane

C12H10O

HCID45099584

2-(Hydroxymethyl)piperazine-1,4-dicarbaldehyde

C7H12N2O3

结构：OCC1CN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CCO1

HCID54443030

未命名化合物

PRODUCTS

生成物

结构：O=CN1CCN(C=O)C(COCC(O)c2cccc3ccccc23)C1

HCID53655923

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-222355a3f3e140cfb365a78878f0da01
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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