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Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].CC1=C(C=C(C=C1)S(=O)(=O)C1=C(C=CC(NC(=O)C(Br)=C)=C1)N=NC1=C(N)C=CC2=C1C=CC(=C2)S([O-])(=O)=O)S([O-])(=O)=O

InChIKey

InChIKey=QTUYUTJUQCCNBJ-UHFFFAOYSA-L

Formula

C26H19BrN4Na2O9S3

Mass

753.52

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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

Aromatic homopolycyclic compounds

Substituents

2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Anilide - N-arylamide - Toluene - Monocyclic benzene moiety - Sulfone - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Azo compound - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Organic metal halide - Carboxylic acid derivative - Organic alkali metal salt - Bromoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl bromide - Vinyl halide - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic sodium salt - Organic oxygen compound - Amine - Organic salt - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - Aromatic homopolycyclic 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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