Compound Identification
SMILES
CCN1CC2(C(CC(=O)C3=CC=CC=C3)C(C1)(C1=CC=CC=C1C2=O)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=ITIAKBGSKJZALU-UHFFFAOYSA-N
Formula
C22H21N3O6
Mass
423.425
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
Alkyl-phenylketones Benzazocines Tetralins Aryl alkyl ketones Benzoyl derivatives Aralkylamines Piperidines C-nitro compounds Trialkylamines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-nitronaphthalene - Alkyl-phenylketone - 1-nitronaphthalene - Benzazocine - Tetralin - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Aralkylamine - Piperidine - Monocyclic benzene moiety - Tertiary aliphatic amine - Organic nitro compound - Ketone - Tertiary amine - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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