Compound Identification
SMILES
OCCC1=NOC(=C1C(=O)C1=C(N(CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N=N1)N1CCOCC1)C1=CC=CC=C1Cl
InChIKey
InChIKey=QCMCDZSLXJJVSW-UHFFFAOYSA-N
Formula
C27H22ClF6N5O4
Mass
629.94
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
Aryl ketones Dialkylarylamines Chlorobenzenes Aryl chlorides Morpholines Vinylogous amides Triazoles Heteroaromatic compounds Isoxazoles Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Primary alcohols Organofluorides Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Dialkylarylamine - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Morpholine - Oxazinane - Azole - Heteroaromatic compound - Isoxazole - Vinylogous amide - 1,2,3-triazole - Ketone - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Primary alcohol - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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