Structure Information
Structure

Compound Identification

SMILES

CCC(=O)OC1=C(C=CC(=C1)S(=O)(=O)OC1=C(C)C=C(C=C1C)C1=C2C(C)=C(C)SC2=C(Br)C2=CC=CC=C12)C(O)=O

InChIKey

InChIKey=SKVUSPHXOLAKAR-UHFFFAOYSA-N

Formula

C32H27BrO7S2

Mass

667.59

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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

Hydroxybenzoic acid derivatives - Salicylic acid and derivatives

Direct Parent

Sulfosalicylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Naphthothiophene - Sulfosalicylic acid or derivatives - Acylsalicylic acid or derivatives - Acylsalicylic acid - Benzenesulfonate ester - Naphthalene - Phenol ester - Benzenesulfonate - Benzothiophene - 1-benzothiophene - Benzenesulfonyl group - Benzoic acid - Arylsulfonic acid or derivatives - Benzoyl - Phenoxy compound - Xylene - M-xylene - Aryl bromide - Organosulfonic acid ester - Aryl halide - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organobromide - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as sulfosalicylic acids and derivatives. These are salicylic acids (or derivatives thereof) with a sulfate group attached to the benzene ring.

External Descriptors

Not available

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