Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.ClC1=CC=C(C=C1)C1=CC(OC[C@@H]2CCN2)=CN=C1Cl
InChIKey
InChIKey=UGBBCJQFYDNNTB-YDALLXLXSA-N
Formula
C21H22Cl2N2O8
Mass
501.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Tricarboxylic acids and derivatives 2-halopyridines Alkyl aryl ethers Chlorobenzenes Alpha hydroxy acids and derivatives Aryl chlorides Tertiary alcohols Heteroaromatic compounds Azetidines Dialkylamines Azacyclic compounds Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
3-phenylpyridine - Tricarboxylic acid or derivatives - Alkyl aryl ether - Chlorobenzene - 2-halopyridine - Halobenzene - Alpha-hydroxy acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Azetidine - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Carboxylic acid - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Alcohol - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - 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