Compound Identification
SMILES
NC1=C(C#N)C(N2C(OC3=CC=CC=C23)=C1C#N)C1=CC=CC=C1
InChIKey
InChIKey=HHKZJUFIUKKDEV-UHFFFAOYSA-N
Formula
C19H12N4O
Mass
312.332
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazolines
Alternative Parents
Dihydropyridines Benzene and substituted derivatives Ketene acetals Oxacyclic compounds Nitriles Enamines Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - Dihydropyridine - Monocyclic benzene moiety - Benzenoid - Ketene acetal or derivatives - Enamine - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.
External Descriptors
Not available