Compound Identification
SMILES
[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)C1=CC=C(NC2=NC(NC3=C4C(=CC(=C3)S([O-])(=O)=O)C=C(C(=NNC3=C(C5=CC=CC=C5C=C3)S([O-])(=O)=O)C4=O)S([O-])(=O)=O)=NC(Cl)=N2)C=C1
InChIKey
InChIKey=SFYGSZNDXVAWLK-UHFFFAOYSA-J
Formula
C29H16ClN7Na4O13S4
Mass
926.13
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 Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds 1,3,5-triazine-2,4-diamines Phenylhydrazines Aniline and substituted anilines Aryl ketones Chloro-s-triazines Aryl chlorides Vinylogous amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Secondary amines Organic metal halides Azacyclic compounds Hydrazones Organochlorides Organic sodium salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 2,4-diamine-s-triazine - Phenylhydrazine - Aryl ketone - Aniline or substituted anilines - Amino-1,3,5-triazine - Chloro-s-triazine - Halo-s-triazine - Aminotriazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Vinylogous amide - Organic sulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Ketone - Organoheterocyclic compound - Organic alkali metal salt - Organic metal halide - Hydrazone - Secondary amine - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organic salt - Organic oxygen compound - Organosulfur compound - Organic oxide - Organic sodium salt - Organic nitrogen compound - Hydrocarbon derivative - 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