Compound Identification
SMILES
[Na+].[Na+].[Na+].NC1=C2C(=O)C=C(C=C2C=C(\C1=N/NC1=CC=C(C=C1)S(=O)(=O)CCOS(O)(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O
InChIKey
InChIKey=GRXIRRIUAYYSQJ-MDHBWZFVSA-L
Formula
C18H15N3Na3O13S4
Mass
678.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonyl compounds
Alternative Parents
Phenylhydrazines Sulfuric acid monoesters Alkyl sulfates Vinylogous amides Sulfones Organosulfonic acids Ketones Hydrazones Enamines Organopnictogen compounds Organic sodium salts Organic oxides Monoalkylamines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Benzenesulfonyl group - Phenylhydrazine - Sulfuric acid monoester - Sulfate-ester - Alkyl sulfate - Sulfuric acid ester - Organic sulfuric acid or derivatives - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Vinylogous amide - Ketone - Organic alkali metal salt - Enamine - Hydrazone - Organopnictogen compound - Organic sodium salt - Organic oxygen compound - Carbonyl group - Primary amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic salt - Primary aliphatic amine - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors
Not available