Structure Information
Structure

Compound Identification

SMILES

ClC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)N1CCN(CC1)C(=O)C1=NC=C(C=C1)C1=CC=NC=C1

InChIKey

InChIKey=UNMQSEKRWUCDJA-UHFFFAOYSA-N

Formula

C25H21ClN4O3S

Mass

492.98

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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

2-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - Bipyridine - Chloronaphthalene - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl chloride - Aryl halide - Pyridine - 1,4-diazinane - Organosulfonic acid amide - Piperazine - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-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 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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