Compound Identification
SMILES
[Na+].CC(=O)Nc1cccc2ccc(O)c(\N=N\c3cc(Cl)cc(c3O)S([O-])(=O)=O)c12
InChIKey
InChIKey=VMGPESHNHVBCDP-QUABFQRHSA-M
Formula
C18H13ClN3NaO6S
Mass
457.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthols and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthols and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthols and derivatives
Alternative Parents
Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds N-acetylarylamines P-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Chlorobenzenes Aryl chlorides Organosulfonic acids Sulfonyls Acetamides Secondary carboxylic acid amides Azo compounds Propargyl-type 1,3-dipolar organic compounds Organic metal halides Carbonyl compounds Organic oxides Organic sodium salts Organochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthol - Benzenesulfonate - Arylsulfonic acid or derivatives - N-acetylarylamine - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 4-halophenol - 4-chlorophenol - N-arylamide - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Acetamide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - Secondary carboxylic acid amide - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic metal halide - Carboxylic acid derivative - Organic alkali metal salt - Organohalogen compound - Organic sodium salt - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic salt - Carbonyl group - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
External Descriptors
Not available