Compound Identification
SMILES
O[C@@H]1CCN2[C@@H]1C(=O)N(C2=O)C1=CC=C(C2=CC=CC=C12)[N+]([O-])=O
InChIKey
InChIKey=UCFITUSUJMLGAM-KGLIPLIRSA-N
Formula
C16H13N3O5
Mass
327.296
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
Hydantoins Alpha amino acids and derivatives Nitroaromatic compounds N-acyl ureas Pyrrolidines Dicarboximides Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic zwitterions Carbonyl compounds Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-nitronaphthalene - Hydantoin - Alpha-amino acid or derivatives - Nitroaromatic compound - N-acyl urea - Ureide - Imidazolidinone - Dicarboximide - Imidazolidine - Pyrrolidine - Organic nitro compound - Urea - Secondary alcohol - Carbonic acid derivative - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organonitrogen compound - Carbonyl group - Organooxygen compound - 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