Compound Identification
SMILES
COC1=CC=C(C2=CC(=NN12)C(F)(F)F)C1=C(Cl)C2=C(C=C1)C=NC=C2
InChIKey
InChIKey=TUSHOZZNJYAWEX-UHFFFAOYSA-N
Formula
C18H11ClF3N3O
Mass
377.75
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 Pyridines and derivatives Benzenoids Aryl chlorides Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Pyrazolopyridine - Alkyl aryl ether - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Pyrazole - Azole - Heteroaromatic compound - Ether - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Alkyl halide - 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