Structure Information
Structure

Compound Identification

SMILES

[H+].[Na+].[Na+].[Cr+3].COC1=NC(Cl)=NC(NC2=CC3=CC(=C(N=NC4=CC=CC=C4C([O-])=O)C([O-])=C3C=C2)S([O-])(=O)=O)=N1.COC1=NC(Cl)=NC(NC2=CC3=CC(=C(N=NC4=CC=CC=C4C([O-])=O)C([O-])=C3C=C2)S([O-])(=O)=O)=N1

InChIKey

InChIKey=XDEIRYCOKSRFES-UHFFFAOYSA-I

Formula

C42H25Cl2CrN12Na2O14S2

Mass

1154.73

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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 - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Benzoic acid or derivatives - Arylsulfonic acid or derivatives - 2-methoxy-1,3,5-triazine - Benzoyl - Alkoxy-s-triazine - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Alkyl aryl ether - Phenoxide - Aminotriazine - Monocyclic benzene moiety - 1,3,5-triazine - Triazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Amino acid - Azo compound - Carboxylic acid salt - Propargyl-type 1,3-dipolar organic compound - Organic metal halide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Secondary amine - Organic transition metal salt - Azacycle - Organic alkali metal salt - Carboxylic acid derivative - Ether - Carboxylic acid - Organic sodium salt - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxide - Organic chromium salt - Amine - 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

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