Structure Information
Structure

Compound Identification

SMILES

OCC1=NC=CC(=C1)C1=CC=C(C=C1)C(=O)N1CCN(CC1)S(=O)(=O)C1=CC2=C(C=C1)C=C(Cl)C=C2

InChIKey

InChIKey=AFOCODNHTMRIFV-UHFFFAOYSA-N

Formula

C27H24ClN3O4S

Mass

522.02

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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 sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - 4-phenylpyridine - Chloronaphthalene - Benzamide - Benzoic acid or derivatives - Benzoyl - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyridine - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Sulfonyl - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Aromatic alcohol - Hydrocarbon derivative - Primary alcohol - Alcohol - 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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