Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=C(NC2=CC3=C(CCC3)C=C2)C(=CN=C1)C#N
InChIKey
InChIKey=JFJXUGRUMFXVRP-UHFFFAOYSA-N
Formula
C23H21N3O2
Mass
371.44
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 Indanes Phenoxy compounds Anisoles 3-pyridinecarbonitriles Aminopyridines and derivatives Alkyl aryl ethers Primary aromatic amines Heteroaromatic compounds Secondary amines Nitriles Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyridine - O-dimethoxybenzene - Dimethoxybenzene - Indane - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 3-pyridinecarbonitrile - Alkyl aryl ether - Aminopyridine - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Heteroaromatic compound - Azacycle - Nitrile - Carbonitrile - Ether - Secondary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Cyanide - Amine - Organic oxygen compound - 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