Compound Identification
SMILES
[Na+].[Na+].[Na+].[O-][N+](=O)C1=CC=C(NN=C2C=C(N=NC3=CC=C(C4=CC=CC=C34)S([O-])(=O)=O)C(=O)C(=NNC3=C4C(=O)C(=NNC5=CC=C(C=C5)[N+]([O-])=O)C(=CC4=CC(=C3)S([O-])(=O)=O)S([O-])(=O)=O)C2=O)C=C1
InChIKey
InChIKey=RDAWDSKDMADWHT-UHFFFAOYSA-K
Formula
C38H21N10Na3O16S3
Mass
1038.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
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Level 5
Naphthalene sulfonates
- Level 6 1-naphthalene sulfonates
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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 1-sulfo,2-unsubstituted aromatic compounds Nitrobenzenes Phenylhydrazines Aryl ketones M-benzoquinones Nitroaromatic compounds Vinylogous amides Sulfonyls Organosulfonic acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrazones Organic oxides Organic sodium salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Nitroaromatic compound - Quinone - Phenylhydrazine - Aryl ketone - M-benzoquinone - Monocyclic benzene moiety - Organosulfonic acid - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Cyclic ketone - Ketone - C-nitro compound - Azo compound - Organic nitro compound - Hydrazone - Organic alkali metal salt - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Organic sodium salt - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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