Compound Identification
SMILES
CC(C)N(C(=O)C1CCC(C)CC1)C1=C(SC2=C1C=CC=C2C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(O)=O
InChIKey
InChIKey=SKDRKNAPBDIPMA-UHFFFAOYSA-N
Formula
C28H27F6NO3S
Mass
571.58
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
1-benzothiophenes Thiophene carboxylic acids Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzothiophene - 1-benzothiophene - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Amino acid - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Carbonyl group - Organic nitrogen compound - Organic oxide - Alkyl fluoride - Hydrocarbon derivative - 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