HCID59441978

N-ethyl-N-methyl-2-[6-(methyloxy)-7-nitro-3,4-dihydro-1(2H)-quinolinyl]-2-oxoethanamine

2-[ethyl(methyl)amino]-1-(6-methoxy-7-nitro-3,4-dihydro-2H-quinolin-1-yl)ethanone

C15H21N3O4307.34 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: CCN(C)CC(=O)N1CCCc2cc(OC)c([N+](=O)[O-])cc21
InChIKey: QMCLLMHJVDFYCI-UHFFFAOYSA-N
分子式: C15H21N3O4
平均分子量: 307.34 g/mol
单同位素质量: 307.15320616

COMPUTED

结构计算性质

已同步

XLogP: 1.9
极性表面积: 78.6 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 4
重原子: 22
形式电荷: 0
复杂度: 412

ALIASES

名称与别名

共 4 条

SCHEMBL2203482QMCLLMHJVDFYCI-UHFFFAOYSA-NN-ethyl-N-methyl-2-[6-(methyloxy)-7-nitro-3,4-dihydro-1(2 H)-quinolinyl]-2-oxoethanamineN-ethyl-N-methyl-2-[6-(methyloxy)-7-nitro-3,4-dihydro-1(2H)-quinolinyl]-2-oxoethanamine

REACTIONS

参与反应

3 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看

uspto-grants-2011_07 · 10.6084/m9.figshare.5104873.v1 · US07981903B2

查看

uspto-grants-2011_07 · 10.6084/m9.figshare.5104873.v1 · US07981903B2

查看