Compound Identification
SMILES
CCC1=C(N=C(N)C(C#N)=C1C1=CC2=C(OCO2)C=C1[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=HRTFDCACTILDJH-UHFFFAOYSA-N
Formula
C21H16N4O4
Mass
388.383
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Benzodioxoles 3-pyridinecarbonitriles Nitroaromatic compounds Aminopyridines and derivatives Primary aromatic amines Benzene and substituted derivatives Imidolactams Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Acetals Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Organic salts Hydrocarbon derivatives Organopnictogen compounds Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyridine - 4-phenylpyridine - Benzodioxole - Nitroaromatic compound - 3-pyridinecarbonitrile - Aminopyridine - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Imidolactam - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Carbonitrile - Nitrile - Acetal - Organic oxoazanium - Amine - Cyanide - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary amine - Hydrocarbon derivative - Organic zwitterion - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available