Compound Identification
SMILES
COC1=CC=C(C2=CC(=NN12)C(F)(F)F)C1=CC2=C(C=C1)C=[N+]([O-])C=C2
InChIKey
InChIKey=MDXUBJBOTAOZAP-UHFFFAOYSA-N
Formula
C18H12F3N3O2
Mass
359.308
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Pyrazolopyridines Alkyl aryl ethers Pyridinium derivatives Benzenoids Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Pyrazolopyridine - Alkyl aryl ether - Pyridine - Pyridinium - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Ether - Azacycle - Alkyl halide - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available