Compound Identification
SMILES
OC(=O)C(F)(F)F.O=C(NC1=NC2=CC=CC=C2C=C1)C1=NOC(=C1)C1=CC=CC=C1
InChIKey
InChIKey=UWNJYXXRBPASDI-UHFFFAOYSA-N
Formula
C21H14F3N3O4
Mass
429.355
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-heteroaryl carboxamides Benzene and substituted derivatives Imidolactams Pyridines and derivatives Isoxazoles Heteroaromatic compounds Alpha-halocarboxylic acids Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds
Molecular Framework
Not available
Substituents
Quinoline - 2-heteroaryl carboxamide - Pyridine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Isoxazole - Alpha-halocarboxylic acid - Heteroaromatic compound - Azole - Alpha-halocarboxylic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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