Compound Identification
SMILES
[Na+].CC1=NN(C(=N)\C1=N/NC1=CC(Cl)=C(C=C1Cl)S([O-])(=O)=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=TXBLQUFIOIBUID-CSKVMTSOSA-M
Formula
C16H11Cl3N5NaO3S
Mass
482.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonic acids and derivatives
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Phenylhydrazines Dichlorobenzenes Aryl chlorides Imidolactams Sulfonyls Pyrazolines Organosulfonic acids Amidines Azacyclic compounds Hydrazones Organic metal halides Organic sodium salts Organic oxides Organic zwitterions Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 1,4-dichlorobenzene - Phenylhydrazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Imidolactam - Pyrazoline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amidine - Organic metal halide - Azacycle - Hydrazone - Organic alkali metal salt - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic sodium salt - Organic oxide - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
External Descriptors
Not available