Compound Identification
SMILES
COC(=O)N1CCN(C(CN2CCC(C2)C(=O)CC2=CC(Cl)=C(Cl)C=C2)C1)C(=O)CC1=C(N)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=XHQFPVBGIRLKSY-UHFFFAOYSA-N
Formula
C28H31Cl2F3N4O4
Mass
615.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
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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
Phenylacetamides Piperazine carboxylic acids Aniline and substituted anilines Dichlorobenzenes Aryl chlorides Beta-amino ketones Gamma-amino ketones N-alkylpyrrolidines Methylcarbamates Tertiary carboxylic acid amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organochlorides Organofluorides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Phenylacetamide - Piperazine-1-carboxylic acid - 1,2-dichlorobenzene - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Gamma-aminoketone - Aryl chloride - Aryl halide - Beta-aminoketone - N-alkylpyrrolidine - Piperazine - 1,4-diazinane - Methylcarbamate - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Ketone - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organochloride - Organohalogen 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