Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C1=CC2=C(C=C1)C=CC1=C2OC2=C(C=CC3=C2C=C(C=C3)S(O)(=O)=O)S1(=O)=O

InChIKey

InChIKey=VYWYGQYQLSLYMT-UHFFFAOYSA-N

Formula

C20H12O9S3

Mass

492.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxathiins

Subclass

Phenoxathiins

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxathiins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalene sulfonate - Naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonate - Phenoxathiin - Diaryl ether - Naphthalene - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - 1,4-oxathiin - Benzenoid - Sulfonyl - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Oxacycle - Ether - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxathiins. These are polycyclic aromatic compounds containing a phenoxathiin moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a 1,4-oxathiin ring.

External Descriptors

Not available

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