Structure Information
Structure

Compound Identification

SMILES

[O-]OOSC1=CC(=CC(=C1)C(=O)OCC1CCCCC1)C(=O)OCC1CCCCC1

InChIKey

InChIKey=YJRUVNZKXHHEFM-UHFFFAOYSA-M

Formula

C22H29O7S

Mass

437.53

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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 - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - M-sulfanylbenzoic acid or derivatives - Benzoate ester - Benzoyl - Carboxylic acid ester - Sulfenyl compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic anion - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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