Structure Information
Structure

Compound Identification

SMILES

Cl.CN1CCN(CC2=CC=C(C=C2)C(=O)NN(C2CCCC2)C2=NC(=NC=C2Br)C#N)CC1

InChIKey

InChIKey=AEQQWLITLXVDAD-UHFFFAOYSA-N

Formula

C23H29BrClN7O

Mass

534.89

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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

Not available

Direct Parent

Benzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoic acid or derivatives - Benzoyl - Benzylamine - Phenylmethylamine - Halopyrimidine - N-methylpiperazine - N-alkylpiperazine - Aralkylamine - Aryl bromide - Imidolactam - Pyrimidine - Piperazine - Aryl halide - 1,4-diazinane - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid hydrazide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Nitrile - Carbonitrile - Hydrocarbon derivative - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrochloride - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.

External Descriptors

Not available

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