HRID86582

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID62324

Propanoyl chloride

C3H5ClO

HCID70048

Norcyclizine

C17H20N2

HCID53824140

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C=CC=CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c(OC)c1OC

HCID53821346

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-897549896a82441d9ad23b93da04936e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:60]([O:61][CH2:62][CH3:63])(=[O:64])[CH3:65].[CH2:27]([C:28]([Cl:29])=[O:30])[CH3:31].[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:18])[OH:19])[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:54][CH2:55][CH2:56][CH2:57][CH2:58][CH3:59].[CH:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1.[Cl:51][CH2:52][Cl:53].[OH2:66]>>[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:19])[N:48]2[CH2:47][CH2:46][N:45]([CH:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:50][CH2:49]2)[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]