Compound Identification
SMILES
[Na+].[Na+].CC1=CC(N=NC2=CC(N=NC3=CC(=C4C=CC=C(C4=C3)S([O-])(=O)=O)S([O-])(=O)=O)=C(C)C=C2)=C(C=C1)N=NC1=CC(=C(N)C=C1N)[N+]([O-])=O
InChIKey
InChIKey=NRRLXVUFHBBPDA-UHFFFAOYSA-L
Formula
C30H23N9Na2O8S2
Mass
747.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
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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 Azobenzenes 1-sulfo,2-unsubstituted aromatic compounds Nitrobenzenes Aniline and substituted anilines Nitroaromatic compounds Toluenes Sulfonyls Organosulfonic acids Azo compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic sodium salts Hydrocarbon derivatives Primary amines Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Azobenzene - 1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Arylsulfonic acid or derivatives - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Nitroaromatic compound - Aniline or substituted anilines - Toluene - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - C-nitro compound - Organic nitro compound - Organic alkali metal salt - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Primary amine - Organosulfur compound - Organonitrogen compound - Amine - Organic sodium salt - Organic oxygen compound - Organic oxide - 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