Structure Information
Structure

Compound Identification

SMILES

CC(C)OC1=NC(Cl)=NC(NC2=CC(NC(N)=O)=C(C=C2)N=NC2=C(C=C3C=C(C=C(C3=C2)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)=N1

InChIKey

InChIKey=PXSBRQKKQGTZGM-UHFFFAOYSA-N

Formula

C23H21ClN8O11S3

Mass

717.1

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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 - Alkoxy-s-triazine - Aniline or substituted anilines - Alkyl aryl ether - Chloro-s-triazine - Halo-s-triazine - Amino-1,3,5-triazine - Aminotriazine - Triazine - Aryl chloride - Monocyclic benzene moiety - Aryl halide - 1,3,5-triazine - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Urea - Azo compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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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