Compound Identification
SMILES
O=C1O[C@@H](COC2=NOC=C2)CN1C1=CC=C(C=C1)C1=CN=C(C=C1)C1(CC1)C#N
InChIKey
InChIKey=ISJAQPLQHYUGRW-GOSISDBHSA-N
Formula
C22H18N4O4
Mass
402.41
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
Alkyl aryl ethers Oxazolidinones Benzene and substituted derivatives Isoxazoles Heteroaromatic compounds Carbamate esters Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyridine - Alkyl aryl ether - Monocyclic benzene moiety - Oxazolidinone - Benzenoid - Azole - Isoxazole - Oxazolidine - Carbamic acid ester - Heteroaromatic compound - Nitrile - Carbonitrile - Ether - Azacycle - Oxacycle - Organic oxide - Cyanide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - 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