Compound Identification
SMILES
COC1=CC(=C(OC)C=C1)C1=[NH+]C(N)=C(C#N)C(=C1)C1=CC(OC)=CC=C1
InChIKey
InChIKey=XBPJEJQIHZPHHO-UHFFFAOYSA-O
Formula
C21H20N3O3
Mass
362.408
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
-
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
Dimethoxybenzenes Phenoxy compounds Anisoles 3-pyridinecarbonitriles Aminopyridines and derivatives Alkyl aryl ethers Pyridinium derivatives Heteroaromatic compounds Nitriles Azacyclic compounds Primary amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - 4-phenylpyridine - P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 3-pyridinecarbonitrile - Alkyl aryl ether - Aminopyridine - Monocyclic benzene moiety - Benzenoid - Pyridinium - Heteroaromatic compound - Ether - Carbonitrile - Nitrile - Azacycle - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Cyanide - Primary amine - Organic cation - Aromatic heteromonocyclic 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