HRID675476

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID3283

Diethyl Ether

C4H10O

HCID24729482

tert-Butyl 4-(aminooxy)piperidine-1-carboxylate

C10H20N2O3

HCID57893467

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(ON=C(c2ccccc2)c2cc3ccncc3[nH]2)CC1

HCID136386509

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9088b2052ab74782933525406668baee
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

[CH3:34][CH2:35][OH:36].[CH3:37][CH2:38][O:39][CH2:40][CH3:41].[ClH:33].[NH2:18][O:19][CH:20]1[CH2:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]1.[c:1]1([C:7](=[O:8])[c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14][cH:15][cH:16]3)[nH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14][cH:15][cH:16]3)[nH:17]2)=[N:18][O:19][CH:20]2[CH2:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1