Compound Identification
SMILES
OC(=O)COC1=CC2=C(C=C1)C=C(C=C2)C1=NC(=CC(OCC(O)=O)=N1)C(F)(F)F
InChIKey
InChIKey=POFLCEPSUIVRLR-UHFFFAOYSA-N
Formula
C19H13F3N2O6
Mass
422.316
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
Naphthalenes Phenol ethers Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Dicarboxylic acids and derivatives Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - Naphthalene - Phenol ether - Alkyl aryl ether - Dicarboxylic acid or derivatives - Pyrimidine - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organoheterocyclic compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl halide - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available