Structure Information
Structure

Compound Identification

SMILES

CN1CC23CN(CC(=O)N2CC2(CCN(CC2)C2=NCCCC2)N3C1=O)S(=O)(=O)C1=CC2=C(C=C1)C=C(Cl)C=C2

InChIKey

InChIKey=JEUQYWYMHNPITA-UHFFFAOYSA-N

Formula

C28H33ClN6O4S

Mass

585.12

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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 - Chloronaphthalene - Alpha-amino acid or derivatives - Azaspirodecane - Imidazopyrazine - Tetrahydropyridine - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Hydropyridine - Imidazolidinone - Piperazine - Piperidine - Organosulfonic acid amide - Imidolactam - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Imidazolidine - Urea - Carboxamide group - Lactam - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid amidine - Organoheterocyclic compound - Azacycle - Carboximidamide - Carboxylic acid derivative - Amidine - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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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