Structure Information
Structure

Compound Identification

SMILES

NC(=O)NC1=C(C=CC(NC2=NC(NC3=CC(=CC=C3)S(=O)(=O)CCOS(O)(=O)=O)=NC(Cl)=N2)=C1)N=NC1=C(C=C2C=C(C=C(C2=C1)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=BLYVOCSVMBEJLS-UHFFFAOYSA-N

Formula

C28H24ClN9O16S5

Mass

938.3

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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 heteropolycyclic compounds

Substituents

1-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 2-naphthalene sulfonate - N-phenylurea - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Aniline or substituted anilines - 2,4-diamine-s-triazine - Aminotriazine - Halo-s-triazine - Chloro-s-triazine - Amino-1,3,5-triazine - Triazine - Monocyclic benzene moiety - 1,3,5-triazine - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Aryl halide - Alkyl sulfate - Aryl chloride - Heteroaromatic compound - Organic sulfuric acid or derivatives - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Urea - Azo compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - 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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