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Structure Information
Structure

Compound Identification

SMILES

CC1=CC(N=NC2=C3C=CC=C(C3=C(NC3=NC(Cl)=NC(Cl)=N3)C=C2)S(O)(=O)=O)=C(C)C=C1N=NC1=C(C=CC(=C1)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=YYMOTGDYOPIKIR-UHFFFAOYSA-N

Formula

C27H20Cl2N8O9S3

Mass

767.58

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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

Azobenzene - 1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Xylene - P-xylene - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Aminotriazine - Monocyclic benzene moiety - Triazine - Aryl halide - Aryl chloride - 1,3,5-triazine - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Organosulfonic acid - Heteroaromatic compound - Azo compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organosulfur compound - Organic oxide - 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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