Structure Information
Structure

Compound Identification

SMILES

CCCCNC1=C(C#N)C(Cl)=C(C#N)C(Cl)=C1Cl

InChIKey

InChIKey=DBTOVRABLPDBDR-UHFFFAOYSA-N

Formula

C12H10Cl3N3

Mass

302.58

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Chlorobenzenes Aryl chlorides Nitriles Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzonitrile - Phenylalkylamine - Aniline or substituted anilines - Chlorobenzene - Secondary aliphatic/aromatic amine - Halobenzene - Aryl chloride - Aryl halide - Secondary amine - Carbonitrile - Nitrile - Organonitrogen compound - Amine - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

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