Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C1=CC(NC(=O)C2=CC(NC(=O)C(Br)=C)=CC=C2)=C2C(=C1)C=C(\C(=N/NC1=C(C=CC(NC(=O)C(Br)=C)=C1)S(O)(=O)=O)C2=O)S(O)(=O)=O

InChIKey

InChIKey=QJNKJFYMPVVCFJ-YRRMYEEHSA-N

Formula

C29H21Br2N5O13S3

Mass

903.5

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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

Acylaminobenzoic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Naphthalene - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzamide - Benzenesulfonyl group - Anilide - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - Phenylhydrazine - Aryl ketone - N-arylamide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Vinylogous amide - Carboxamide group - Ketone - Secondary carboxylic acid amide - Haloalkene - Vinyl halide - Vinyl bromide - Carboxylic acid derivative - Hydrazone - Bromoalkene - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.

External Descriptors

Not available

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