Compound Identification
SMILES
CCCCCCOC(=O)[C@@H]1CCN(C1)C1CCN(CC1)C(=O)[C@@H](CC1=CC(=C(N)C(Cl)=C1)C(F)(F)F)OC(=O)N1CCC(CC1)N1CCC2=CC=CC=C2NC1=O
InChIKey
InChIKey=SGHVJZVHHIJTEO-BVGRYSDNSA-N
Formula
C41H54ClF3N6O6
Mass
819.36
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
N-acylpiperidines Piperidinecarboxylic acids Pyrrolidine carboxylic acids Aniline and substituted anilines Aminopiperidines Chlorobenzenes Aryl chlorides N-alkylpyrrolidines Tertiary carboxylic acid amides Carbamate esters Ureas Trialkylamines Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Primary amines Organic oxides Organochlorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - N-acyl-piperidine - Piperidinecarboxylic acid - Aniline or substituted anilines - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 4-aminopiperidine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - N-alkylpyrrolidine - Piperidine - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Urea - Carboxylic acid ester - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organooxygen compound - Primary amine - Amine - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteropolycyclic 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