Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C1=C(NNC2=CC(=C(NN=C3C(=O)C4=C(C=C3S(O)(=O)=O)C=C(C(=NNC3=C(C=C(C=C3)[N+]([O-])=O)S(O)(=O)=O)C4=O)S(O)(=O)=O)C=C2)S(O)(=O)=O)C(=O)N=N1

InChIKey

InChIKey=ZMXYYTLJXKNRTO-UHFFFAOYSA-N

Formula

C29H25N9O17S4

Mass

899.81

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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

2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Alpha-amino acid or derivatives - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Nitroaromatic compound - Phenylhydrazine - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Hydrazone - Organic oxoazanium - Organic salt - Organic oxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Hydrazine derivative - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - 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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