Compound Identification
SMILES
NC1=CC2=C3C(=C1)C=C(C=C3C(=O)N(CCNCCO)C2=O)[N+]([O-])=O
InChIKey
InChIKey=QKNBEEJDJQDHMW-UHFFFAOYSA-N
Formula
C16H16N4O5
Mass
344.327
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 Nitroaromatic compounds N-substituted carboxylic acid imides Amino acids and derivatives 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Dialkylamines Azacyclic compounds Primary amines Primary alcohols Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-nitronaphthalene - Isoquinolone - Nitroaromatic compound - Carboxylic acid imide, n-substituted - Carboxylic acid imide - 1,2-aminoalcohol - Amino acid or derivatives - Organic nitro compound - C-nitro compound - Alkanolamine - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic salt - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Primary alcohol - Primary amine - Alcohol - Organic zwitterion - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - 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