Compound Identification
SMILES
NC1=C(C#N)C(C(C(C2=CC=C(Cl)C=C2)C1(C#N)C#N)[N+]([O-])=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=YKKOQNHYZKWNGQ-UHFFFAOYSA-N
Formula
C21H13Cl2N5O2
Mass
438.27
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
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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
Aryl chlorides C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Enamines Organochlorides Organic zwitterions Organic salts Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorobenzene - Aryl chloride - Aryl halide - Organic nitro compound - C-nitro compound - Enamine - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Amine - Organonitrogen compound - Organochloride - Primary amine - Organohalogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic 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