Compound Identification
SMILES
CC1=CC=C(N)C=C1.OS(=O)(=O)C1=CC=CC=C1\C=N\NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=DAVOEMQYZNVJBT-XHIXCECLSA-N
Formula
C20H19N5O7S
Mass
473.46
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 Nitrobenzenes Aminotoluenes Phenylhydrazines Aniline and substituted anilines Nitroaromatic compounds Sulfonyls Organosulfonic acids Propargyl-type 1,3-dipolar organic compounds Hydrazones Organic oxoazanium compounds Primary amines Organic salts Hydrocarbon derivatives Organic zwitterions Organic oxides
Molecular Framework
Not available
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Nitroaromatic compound - Phenylhydrazine - Aniline or substituted anilines - Aminotoluene - Toluene - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrazone - Organic oxoazanium - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic salt - 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