Structure Information
Structure

Compound Identification

SMILES

[Ca++].CCCCCCCCCC1=C(OC2=CC=CC=C2)C=C(C=C1O)S(O)(=O)=O.CCCCCCCCCC1=C(OC2=CC=CC=C2)C=C(C=C1[O-])S([O-])(=O)=O

InChIKey

InChIKey=WCMABLFCCPAKAM-UHFFFAOYSA-L

Formula

C42H54CaO10S2

Mass

823.08

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Diphenylethers

Intermediate Tree Nodes

Not available

Direct Parent

Diphenylethers

Alternative Parents

Molecular Framework

Not available

Substituents

Diphenylether - Diaryl ether - Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Phenoxy compound - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Phenoxide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic calcium salt - Ether - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic salt - Organic oxide - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.

External Descriptors

Not available

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