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Structure Information
Structure

Compound Identification

SMILES

CONC(=O)C1=CC(NC2=NC=NN3C=C(NC(=O)OCCCS(C)(=O)=O)C(C(C)C)=C23)=C(F)C=C1F

InChIKey

InChIKey=ITQSJZWWFWDOKJ-UHFFFAOYSA-N

Formula

C22H26F2N6O6S

Mass

540.54

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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

Aminobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aminobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Pyrrolo[2,1-f][1,2,4]triazine - Benzoyl - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - 1,2,4-triazine - Substituted pyrrole - Triazine - Imidolactam - Heteroaromatic compound - Pyrrole - Sulfone - Sulfonyl - Vinylogous halide - Carbamic acid ester - Amino acid or derivatives - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.

External Descriptors

Not available

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