Compound Identification
SMILES
[Fe].OC1=CC=CC(=O)\C1=N\NC1=CC(Cl)=CC(=C1O)S(O)(=O)=O
InChIKey
InChIKey=MWQJOVBWMXBWTJ-KRWCAOSLSA-N
Formula
C12H9ClFeN2O6S
Mass
400.57
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
Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Phenylhydrazines P-chlorophenols Chlorobenzenes Aryl chlorides Sulfonyls Organosulfonic acids Cyclic ketones Organic transition metal salts Hydrazones Enols Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - 4-halophenol - 4-chlorophenol - Phenylhydrazine - Chlorobenzene - Phenol - Halobenzene - Aryl halide - Aryl chloride - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Cyclic ketone - Ketone - Organic transition metal salt - Enol - Hydrazone - Organooxygen compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic homomonocyclic 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