Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC1CN(CCN1C(=O)C1=CC=C(C=C1)C1=CC=CC=N1)S(=O)(=O)C1=CC2=C(C=C1)C=C(Cl)C=C2

InChIKey

InChIKey=QCGYMYLEOVZEKP-UHFFFAOYSA-N

Formula

C29H26ClN3O5S

Mass

564.05

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