Compound Identification
SMILES
FC(F)(F)C1=CC(=CC(NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N2CCCC2)=C1)C(F)(F)F
InChIKey
InChIKey=PDCNMYHZSKWETJ-UHFFFAOYSA-N
Formula
C21H18F6N2O5S
Mass
524.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Trifluoromethylbenzenes Benzenesulfonamides Anilides Benzenesulfonyl compounds Benzoyl derivatives N-arylamides Organosulfonamides Pyrrolidines Sulfonyls Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Organofluorides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonamide - Benzoate ester - Trifluoromethylbenzene - Benzenesulfonyl group - Anilide - Benzoyl - N-arylamide - Organosulfonic acid amide - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available