Compound Identification
SMILES
OC[C@H]1O[C@H](OC(=O)C2=CC=CC=C2)C(F)(F)C(F)(F)C1(F)F
InChIKey
InChIKey=ZUIHJLPNRCCQFV-PSASIEDQSA-N
Formula
C13H10F6O4
Mass
344.209
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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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
Benzoyl derivatives Oxanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Primary alcohols Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzoyl - Oxane - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Organofluoride - Organooxygen compound - Alkyl halide - Primary alcohol - 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