Compound Identification
SMILES
CCOC1=C(OC)C=C(C=C1)C1=CC(=NC(N)=C1C#N)C1=CC=C(Br)C=C1
InChIKey
InChIKey=QRNNZHQMGOMBBS-UHFFFAOYSA-N
Formula
C21H18BrN3O2
Mass
424.298
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
Phenoxy compounds Methoxybenzenes Anisoles 3-pyridinecarbonitriles Bromobenzenes Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Aryl bromides Heteroaromatic compounds Nitriles Azacyclic compounds Primary amines Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - 4-phenylpyridine - Anisole - Phenoxy compound - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Alkyl aryl ether - Aminopyridine - Bromobenzene - Halobenzene - Imidolactam - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Ether - Nitrile - Carbonitrile - Primary amine - Organic nitrogen compound - Organohalogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - 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