Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@@]1(CC(=O)SC2=CC=CC=C2)NS(=O)(=O)C2=C1C=CC1=CC=CC=C21

InChIKey

InChIKey=PMKXBRAUQAVTQC-QFIPXVFZSA-N

Formula

C22H19NO5S2

Mass

441.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

1-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 1-naphthalene sulfonamide - Naphthothiazole - Alpha-amino acid or derivatives - 1,2-benzothiazole - Thiophenol ester - Aryl thioether - Fatty acid ester - Monocyclic benzene moiety - Organosulfonic acid amide - Fatty acyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Thiocarboxylic acid ester - Carbothioic s-ester - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) 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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