Structure Information
Structure

Compound Identification

SMILES

CCCN(CC1=NC2=C(C=CC(CNCCN(CC)CC)=C2)N1CCC)C(=O)C1=C(F)C=CC(F)=C1

InChIKey

InChIKey=MZKPSGUXDFVKRY-UHFFFAOYSA-N

Formula

C28H39F2N5O

Mass

499.651

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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

2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzamide - Benzimidazole - Benzoyl - Halobenzene - Fluorobenzene - Aralkylamine - N-substituted imidazole - Aryl fluoride - Aryl halide - Imidazole - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous halide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - 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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