Compound Identification
SMILES
OC(CN1C=NC2=CC=CC=C12)CN1CCN(CC1)C1=CC=C(C=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=IUIUCGRZBGUXJJ-UHFFFAOYSA-N
Formula
C26H27ClN4O
Mass
446.98
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
Phenylpiperazines N-arylpiperazines Benzimidazoles Aniline and substituted anilines Dialkylarylamines N-alkylpiperazines Chlorobenzenes N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Azacyclic compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chlorinated biphenyl - Phenylpiperazine - N-arylpiperazine - Benzimidazole - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - N-alkylpiperazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Organoheterocyclic compound - Azacycle - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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