Compound Identification
SMILES
OC(=O)C1=C(O)C=CC(=C1)N1C(=O)C2=CC(=CC3=CC(=CC(C1=O)=C23)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=PAQACDRRAGKUNN-UHFFFAOYSA-N
Formula
C19H9N3O9
Mass
423.293
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Nitronaphthalenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Nitronaphthalenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitronaphthalenes
Alternative Parents
Isoquinolones and derivatives Salicylic acids Benzoic acids Benzoyl derivatives Nitroaromatic compounds 1-hydroxy-2-unsubstituted benzenoids N-substituted carboxylic acid imides Vinylogous acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-nitronaphthalene - Isoquinolone - Hydroxybenzoic acid - Salicylic acid or derivatives - Salicylic acid - Benzoic acid - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Vinylogous acid - Carboxylic acid imide - Organic nitro compound - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.
External Descriptors
Not available