Compound Identification
SMILES
CCCCN(C(=O)C1=C(Br)C=CC(=C1)[N+]([O-])=O)C1=C2C=C3OCOC3=CC2=NC=C1
InChIKey
InChIKey=JJTJVYUIBLPBMY-UHFFFAOYSA-N
Formula
C21H18BrN3O5
Mass
472.295
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
2-halobenzoic acids and derivatives Nitrobenzenes Benzamides Benzodioxoles Benzoyl derivatives Nitroaromatic compounds Bromobenzenes Pyridines and derivatives Aryl bromides Vinylogous halides Tertiary carboxylic acid amides Heteroaromatic compounds Organic oxoazanium compounds Azacyclic compounds Acetals Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organobromides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzodioxole - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous halide - Tertiary carboxylic acid amide - Carboxamide group - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organic oxoazanium - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available