Compound Identification
SMILES
NC1=C(C=C(C[C@@H](OC(=O)N2CCC(CC2)N2CCC3=CC=CC=C3NC2=O)C(=O)N2CCC(CC2)N2CCN3CCCC3C2)C=C1Cl)C(F)(F)F
InChIKey
InChIKey=JUPBNPQDWUNWRP-VCHQGTEKSA-N
Formula
C37H47ClF3N7O4
Mass
746.27
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 Aniline and substituted anilines Aminopiperidines Chlorobenzenes N-alkylpiperazines N-alkylpyrrolidines Aryl chlorides Carbamate esters Tertiary carboxylic acid amides Ureas Trialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organofluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - N-acyl-piperidine - Piperidinecarboxylic acid - Aniline or substituted anilines - 4-aminopiperidine - Chlorobenzene - Halobenzene - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Piperidine - N-alkylpyrrolidine - Pyrrolidine - Carbamic acid ester - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Urea - Tertiary aliphatic amine - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Carbonyl group - Alkyl halide - Alkyl fluoride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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