Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C1=CC2=CC=CC=C2C=C1.CC(=O)N1CC2=NC(=NC=C2C1=O)N1CCNCC1

InChIKey

InChIKey=NDSUKPSKFYJSTQ-UHFFFAOYSA-N

Formula

C22H23N5O5S

Mass

469.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Naphthalene sulfonates

Direct Parent

2-naphthalene sulfonates

Alternative Parents

Molecular Framework

Not available

Substituents

2-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - N-arylpiperazine - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Dialkylarylamine - Aminopyrimidine - Piperazine - Pyrimidine - Carboxylic acid imide, n-substituted - 1,4-diazinane - Carboxylic acid imide - Dicarboximide - Acetamide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group 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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