Compound Identification
SMILES
NC1=C(C=C(C[C@@H](OC(=O)N2CCC(CC2)N2CCC3=CC=CC=C3NC2=O)C(=O)N2CCC(CC2)N2CCN(CC2)C(=O)CCC(O)=O)C=C1Cl)C(F)(F)F
InChIKey
InChIKey=JCFQGSXXUFYUOO-WJOKGBTCSA-N
Formula
C38H47ClF3N7O7
Mass
806.28
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
Piperidinecarboxylic acids N-acylpiperidines Aniline and substituted anilines Aminopiperidines N-alkylpiperazines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Carbamate esters Ureas Trialkylamines Amino acids Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Primary amines Alkyl fluorides Organic oxides Organochlorides Carbonyl compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - N-acyl-piperidine - Piperidinecarboxylic acid - Aniline or substituted anilines - 4-aminopiperidine - Halobenzene - N-alkylpiperazine - Chlorobenzene - Aryl chloride - Piperazine - Piperidine - 1,4-diazinane - Aryl halide - Tertiary carboxylic acid amide - Carbamic acid ester - Tertiary amine - Amino acid - Tertiary aliphatic amine - Urea - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organooxygen compound - Primary amine - Organic nitrogen compound - 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