Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C(F)(F)F.CC[NH2+]C(C)CC1CN(C1)C(=O)C1=C(F)C=CC(CC2=CNC(=O)C3=CC(Cl)=C(Cl)N23)=C1

InChIKey

InChIKey=VBQDHDUOAVBHNP-UHFFFAOYSA-N

Formula

C25H26Cl2F4N4O4

Mass

593.4

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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

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

2-halobenzoic acid or derivatives - Benzamide - Pyrrolopyrazine - Benzoyl - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Pyrazine - Substituted pyrrole - Alpha-halocarboxylic acid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Heteroaromatic compound - Pyrrole - Alpha-halocarboxylic acid or derivatives - Vinylogous halide - Carboxylic acid salt - Carboxamide group - Azetidine - Lactam - Amino acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Secondary amine - Azacycle - Amine - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organochloride - Organofluoride - Organonitrogen compound - Organic zwitterion - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

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