Compound Identification
SMILES
NC(=N)C1=CC2=NC(N=C2C=C1)C1=C(O)C(=CC(=C1)C(CC(O)=O)C(O)=O)C1=CC(F)=CC(Cl)=C1
InChIKey
InChIKey=AVPOSNFJGVTRLC-UHFFFAOYSA-N
Formula
C24H18ClFN4O5
Mass
496.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Chlorinated biphenyls
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Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
Phenylpropanoic acids Benzimidazoles Phenols Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Dicarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carboximidamides Carboxamidines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - 3-phenylpropanoic-acid - Benzimidazole - Chlorobenzene - Fluorobenzene - Halobenzene - Phenol - Aryl fluoride - Aryl halide - Aryl chloride - Dicarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboximidamide - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Amidine - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - Carbonyl group - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorinated biphenyls. These are organic compounds containing at least one chlorine atom attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available