Compound Identification
SMILES
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)C2C1=CC=NC2=CC=CC=C12
InChIKey
InChIKey=IFQUAIUKDZLTRR-UHFFFAOYSA-N
Formula
C21H19N3O2
Mass
345.402
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
Cyclohexenones Pyridines and derivatives Pyrans Benzenoids Vinylogous esters Heteroaromatic compounds Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - Cyclohexenone - Pyran - Pyridine - Benzenoid - Vinylogous ester - Heteroaromatic compound - Ketene acetal or derivatives - Ketone - Azacycle - Nitrile - Carbonitrile - Oxacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aldehyde - Organooxygen compound - Organonitrogen compound - Cyanide - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available