Compound Identification
SMILES
[Na+].[Na+].[Na+].NC1=C(N=NC2=C(C=CC(NC3=C(C=CC(NC4=C(Cl)C(F)=NC(F)=N4)=C3)S([O-])(=O)=O)=C2)S([O-])(=O)=O)C2=C(C=C1)C(=CC=C2)S([O-])(=O)=O
InChIKey
InChIKey=CQZKCYGIFGZYRT-UHFFFAOYSA-K
Formula
C26H15ClF2N7Na3O9S3
Mass
808.04
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
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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 Benzenesulfonic acids and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Aniline and substituted anilines 2-halopyrimidines Aminopyrimidines and derivatives Imidolactams Aryl chlorides Aryl fluorides Primary aromatic amines Organosulfonic acids Heteroaromatic compounds Sulfonyls Azo compounds Secondary amines Azacyclic compounds Organic metal halides Propargyl-type 1,3-dipolar organic compounds Organofluorides Hydrocarbon derivatives Organic oxides Organic sodium salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Aniline or substituted anilines - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Pyrimidine - Aryl halide - Aryl fluoride - Imidolactam - Primary aromatic amine - Aryl chloride - Monocyclic benzene moiety - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - Organic metal halide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Secondary amine - Organic alkali metal salt - Azacycle - Organic oxygen compound - Organic salt - Organosulfur compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Primary amine - Amine - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic cation - 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