Structure Information
Structure

Compound Identification

SMILES

COC1=C2N=C(C)C=C(NC3=C4C(C=C(C=C4S(O)(=O)=O)S(O)(=O)=O)=C(C=C3)S(O)(=O)=O)C2=C(OC)C(=C1)[N+]([O-])=O

InChIKey

InChIKey=LFUCQORKIXFSKP-UHFFFAOYSA-N

Formula

C22H19N3O13S3

Mass

629.58

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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

2-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 2-naphthalene sulfonate - Nitroquinoline - Aminoquinoline - 4-aminoquinoline - Quinoline - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Methoxyaniline - Anisole - Nitroaromatic compound - Phenol ether - Methylpyridine - Alkyl aryl ether - Aminopyridine - Pyridine - Primary aromatic amine - Organosulfonic acid - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Organic sulfonic acid or derivatives - C-nitro compound - Organic nitro compound - Azacycle - Ether - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxide - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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