Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].[Na+].CN(C)C(=O)COC1=C2CC3=CC(=CC(CC4=C(OCC(=O)N(C)C)C(CC5=C(OCC(=O)N(C)C)C(CC1=CC(=C2)S([O-])(=O)=O)=CC(=C5)S([O-])(=O)=O)=CC(=C4)S([O-])(=O)=O)=C3OCC(=O)N(C)C)S([O-])(=O)=O

InChIKey

InChIKey=WMCUYUBEQSCWIH-UHFFFAOYSA-J

Formula

C44H48N4Na4O20S4

Mass

1173.08

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic sulfonic acids and derivatives

Subclass

Organosulfonic acids and derivatives

Intermediate Tree Nodes

Arylsulfonic acids and derivatives - Arylsufonic acids

Direct Parent

1-sulfo,2-unsubstituted aromatic compounds

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-sulfo,2-unsubstituted aromatic compound - Phenol ether - Alkyl aryl ether - Benzenoid - Organosulfonic acid - Sulfonyl - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Ether - Organic alkali metal salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic sodium salt - Organic salt - Organic cation - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-sulfo,2-unsubstituted aromatic compounds. These are an arylsulfonic acid carrying the sulfonic acid group at the 1-position, and no substitute at the 2-position of the aromatic ring.

External Descriptors

Not available

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