Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)OCCS(=O)(=O)C1=CC2=C(C=C1)C(=C(N\N=C1/C(=O)C3=C(C=C(C=C3)S(O)(=O)=O)C=C1S(O)(=O)=O)C=C2)S(O)(=O)=O

InChIKey

InChIKey=GHSOCMMCZJFAJP-GFMRDNFCSA-N

Formula

C22H18N2O16S5

Mass

726.68

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Naphthalene sulfonates

Direct Parent

1-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenylhydrazine - Aryl ketone - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Alkyl sulfate - Organic sulfuric acid or derivatives - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Ketone - Hydrazone - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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