Compound Identification
SMILES
COC1=CC=CC(C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)=C1OCC#C
InChIKey
InChIKey=POCOOEMHEZRMPA-UHFFFAOYSA-N
Formula
C22H20F3N3O4
Mass
447.414
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Anilides Phenoxy compounds N-arylamides Methoxybenzenes Anisoles Alkyl aryl ethers N-acyl amines Haloacetylenes and derivatives Carboxylic acid amides Acetylides Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - Anilide - Phenoxy compound - Methoxybenzene - N-arylamide - Phenol ether - Anisole - Alkyl aryl ether - Fatty acyl - N-acyl-amine - Fatty amide - Carboxamide group - Haloacetylene or derivatives - Acetylide - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available