Structure Information
Structure

Compound Identification

SMILES

ClC1=CC(=CC(Cl)=C1)C(=O)NCC1=NC2=CC=CC=C2N1CC1=CC=CC=C1

InChIKey

InChIKey=WWAKLQMHNHRUAI-UHFFFAOYSA-N

Formula

C22H17Cl2N3O

Mass

410.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

3-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-halobenzoic acid or derivatives - Benzamide - Benzimidazole - Benzoyl - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Aryl halide - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Azole - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.

External Descriptors

Not available

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