当前位置: 首页 » 资料 » 化学物质数据库 » methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate,Canonical SMILES:

methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate,Canonical SMILES:

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:2
摘 要: methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate,Canonical SMILES: COC(=O)C1=CC2=CC3=CC=CC=[N+]3C=C2C=C1,InChI: InChI=1/C15H12NO2/c1-18-15(17)11-5-6-12-10-16-7-3-2-4-14(16)9-13(12)8-,11/h2-10H,1H3/q+1,Molecular Weight238.26128 [g/mol]Molecular Fo
[Synonyms]

[Structure]
 methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate,Canonical SMILES:

[ Properties Computed from Structure]
Molecular Weight238.26128 [g/mol]
Molecular FormulaC15H12NO2+
H-Bond Donor0
H-Bond Acceptor2
Rotatable Bond Count2
Exact Mass238.086804
MonoIsotopic Mass238.086804
Topological Polar Surface Area30.4
Heavy Atom Count18
Formal Charge1
Complexity318
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate
Canonical SMILES: COC(=O)C1=CC2=CC3=CC=CC=[N+]3C=C2C=C1
InChI: InChI=1/C15H12NO2/c1-18-15(17)11-5-6-12-10-16-7-3-2-4-14(16)9-13(12)8-
11/h2-10H,1H3/q+1

 
本文导航:
  • (1) methyl pyrido[1,2-b]isoquinolin-5-ium-9-carboxylate,Canonical SMILES:
  • 下一篇:鳖甲
  • 上一篇:暂无
 
[ 资料搜索 ]  [ 加入收藏 ]  [ 告诉好友 ]  [ 打印本文 ]  [ 关闭窗口 ]

 

 
推荐图文
推荐资料
热门关注