Compound Identification
SMILES
CCN1N=CC2=C(NC3CCN(CC3)C(N)=O)C(=CN=C12)C(=O)NCC1=C(C=C(C)C=C1)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=NECDJYIINZIXOB-UHFFFAOYSA-N
Formula
C29H32ClN7O2
Mass
546.07
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
Pyridinecarboxylic acids and derivatives Pyrazolopyridines Piperidinecarboxamides Toluenes Secondary alkylarylamines Aminopiperidines Aminopyridines and derivatives Chlorobenzenes Aryl chlorides Vinylogous amides Pyrazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - 1-piperidinecarboxamide - Piperidinecarboxamide - Pyrazolopyridine - Pyridine carboxylic acid or derivatives - 4-aminopiperidine - Aminopyridine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Toluene - Aryl chloride - Pyridine - Aryl halide - Piperidine - Vinylogous amide - Heteroaromatic compound - Pyrazole - Azole - Urea - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Organoheterocyclic compound - Organohalogen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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