HRID1128314

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID2756043

tert-Butyl {[3-(aminomethyl)phenyl]methyl}carbamate

C13H20N2O2

HCID2785138

2,4-dichloro-3-nitroquinoline

C9H4Cl2N2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCc1cccc(CNc2c([N+](=O)[O-])c(Cl)nc3ccccc23)c1

HCID86633722

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd2b0c2ce7c14a2c8dd2a072284f5ca3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:8](=[O:9])([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[NH:15][CH2:16][c:17]1[cH:18][c:19]([CH2:23][NH2:24])[cH:20][cH:21][cH:22]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:25][c:26]1[n:27][c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]2[c:34]([Cl:39])[c:35]1[N+:36](=[O:37])[O-:38].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[OH2:40]>>[C:8](=[O:9])([O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[NH:15][CH2:16][c:17]1[cH:18][c:19]([CH2:23][NH:24][c:34]2[c:33]3[c:28]([n:27][c:26]([Cl:25])[c:35]2[N+:36](=[O:37])[O-:38])[cH:29][cH:30][cH:31][cH:32]3)[cH:20][cH:21][cH:22]1