Structure Information
Structure

Compound Identification

SMILES

[Na+].ClC1=NC(=O)N=C(Cl)N1.CC(C)CC1=CC=CC2=C(CC(C)C)C=C(C=C12)S([O-])(=O)=O

InChIKey

InChIKey=XTTAQGONGHQTLQ-UHFFFAOYSA-M

Formula

C21H24Cl2N3NaO4S

Mass

508.39

Export to:

JSON SDF CSV

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 sulfonic acid or derivatives - 2-naphthalene sulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Chloro-s-triazine - Halo-s-triazine - Triazinone - Aryl chloride - Aryl halide - 1,3,5-triazine - Triazine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid - Sulfonyl - Organic metal halide - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic sodium salt - Organic salt - Organic cation - 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

Previous Back Next