Structure Information
Structure

Compound Identification

SMILES

[Cs+].[Cs+].[O-]C(=O)C1=CC(=CC(=C1)C([O-])=O)C1=CC=C(S1)C1=CC2=C(OCCOCCOCCOCCOCCO2)C=C1

InChIKey

InChIKey=MLVBKESLOUCBTH-UHFFFAOYSA-L

Formula

C28H28Cs2O10S

Mass

822.39

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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

Phthalic acid and derivatives

Direct Parent

M-phthalic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta_phthalic_acid - Benzoic acid - Benzoyl - Alkyl aryl ether - 2,5-disubstituted thiophene - Heteroaromatic compound - Thiophene - Carboxylic acid salt - Organoheterocyclic compound - Organic alkali metal salt - Oxacycle - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic zwitterion - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalic acid and derivatives. These are aromatic compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 2.

External Descriptors

Not available

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