Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].[Na+].COC1=C(NC2=NC(NC3=C(C)C=CC=C3NC3=NC(NC4=C(OC)C=C(N=NC5=CC(=C6C=CC=C(C6=C5)S([O-])(=O)=O)S([O-])(=O)=O)C(NC(C)=O)=C4)=NC(Cl)=N3)=NC(Cl)=N2)C=C(NC(C)=O)C(=C1)N=NC1=CC(=C2C=CC=C(C2=C1)S([O-])(=O)=O)S([O-])(=O)=O

InChIKey

InChIKey=ULDCNFPXBJQPOY-UHFFFAOYSA-J

Formula

C51H38Cl2N16Na4O16S4

Mass

1422.06

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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

1-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - Acetanilide - Diaminotoluene - Anilide - Methoxyaniline - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - N-acetylarylamine - Anisole - Phenol ether - Methoxybenzene - N-arylamide - Aniline or substituted anilines - 2,4-diamine-s-triazine - Phenoxy compound - Alkyl aryl ether - Toluene - Aminotriazine - Amino-1,3,5-triazine - Halo-s-triazine - Chloro-s-triazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,3,5-triazine - Triazine - Acetamide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxamide group - Amino acid or derivatives - Azo compound - Secondary carboxylic acid amide - Secondary amine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Organic alkali metal salt - Organic metal halide - Propargyl-type 1,3-dipolar organic compound - Organic salt - Organic sodium salt - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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