Compound Identification
SMILES
COC(=O)COC1=C(OC)C=C(C=NNC(=O)CCC(=O)NC2=CC=CC=C2F)C=C1Br
InChIKey
InChIKey=CAEGUKNRFWKZIQ-UHFFFAOYSA-N
Formula
C21H21BrFN3O6
Mass
510.316
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
Anilides Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Alkyl aryl ethers Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Fatty amides Methyl esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Organobromides Carbonyl compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Anilide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - N-arylamide - Alkyl aryl ether - Halobenzene - Fluorobenzene - Bromobenzene - Aryl bromide - Aryl halide - Fatty acyl - Fatty amide - Aryl fluoride - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organofluoride - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic homomonocyclic 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