Compound Identification
SMILES
CN(\N=C1/CCCC2=C1C(=CO2)C(O)=O)C1=NC=C(Cl)C=C1C(F)(F)F
InChIKey
InChIKey=APYLFPTZCHTVDN-SSDVNMTOSA-N
Formula
C16H13ClF3N3O3
Mass
387.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
Furan-3-carboxylic acids Furoic acids Pyridines and derivatives Aryl chlorides Imidolactams Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Hydrazones Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organooxygen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Furoic acid or derivatives - Furan-3-carboxylic acid - Furan-3-carboxylic acid or derivatives - Furoic acid - Aryl chloride - Aryl halide - Imidolactam - Pyridine - Heteroaromatic compound - Furan - Carboxylic acid derivative - Oxacycle - Azacycle - Carboxylic acid - Hydrazone - Alkyl fluoride - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - 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 benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available