Compound Identification
SMILES
OC(COC1=C(OC(=O)C(F)(F)F)C=CC(O)=C1)CN1CCC(C1)OC1=CC=C(Cl)C=C1
InChIKey
InChIKey=AIGXGAGSZKHCTA-UHFFFAOYSA-N
Formula
C21H21ClF3NO6
Mass
475.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Phenoxy compounds Phenol ethers 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Chlorobenzenes Aryl chlorides N-alkylpyrrolidines Alpha-halocarboxylic acid derivatives 1,2-aminoalcohols Trialkylamines Secondary alcohols Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Organochlorides Alkyl fluorides Carbonyl compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Phenoxy compound - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-alkylpyrrolidine - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Pyrrolidine - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Monocarboxylic acid or derivatives - Azacycle - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Alcohol - Amine - Organic oxide - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available