Compound Identification
SMILES
CCO.CCCN1C\C(=C/C2=CC=CC=C2Cl)C2=C(C1)C(C1=CC=CC=C1Cl)C(C#N)=C(N)O2
InChIKey
InChIKey=ABJJYVCUFFKUGH-KCUXUEJTSA-N
Formula
C27H29Cl2N3O2
Mass
498.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Pyrans Aryl chlorides Trialkylamines Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Primary alcohols Organochlorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Chlorobenzene - Aryl chloride - Aryl halide - Pyran - Ketene acetal or derivatives - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Alcohol - Hydrocarbon derivative - Cyanide - Organooxygen compound - Primary alcohol - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available