Compound Identification
SMILES
[Na+].[Na+].CS(=O)(=O)C1=CC(N=NC2=C(O)C=C3C=CC(NC(=O)C4=CC=C(C=C4)N=NC4=CC=C(C=C4)C(=O)NC4=CC5=C(C(N=NC6=C([O-])C=CC(=C6)S(C)(=O)=O)=C(O)C=C5C=C4)S(O)(=O)=O)=CC3=C2S(O)(=O)=O)=C([O-])C=C1
InChIKey
InChIKey=KEPAGNGYQPBYLN-UHFFFAOYSA-L
Formula
C48H34N8Na2O16S4
Mass
1153.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Level 5
Naphthalene sulfonates
- Level 6 1-naphthalene sulfonates
-
Level 5
Naphthalene sulfonates
-
Subclass
Naphthalene sulfonic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
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
1-naphthalene sulfonic acids and derivatives Naphthols and derivatives Benzamides Arylsulfonic acids and derivatives Benzoyl derivatives Phenoxides 1-hydroxy-2-unsubstituted benzenoids N-acyl amines Sulfones Organosulfonic acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acid amides Organopnictogen compounds Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - 2-naphthol - Benzoic acid or derivatives - Benzamide - Arylsulfonic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenoxide - N-acyl-amine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfone - Carboxamide group - Azo compound - Organic alkali metal salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic homopolycyclic 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