Compound Identification
SMILES
CCOC(=O)COC1=C(NC(=S)CC2=C(F)C=C(Br)C=C2)C=C(C)C(F)=C1
InChIKey
InChIKey=BCWLWNUWCBQBMB-UHFFFAOYSA-N
Formula
C19H18BrF2NO3S
Mass
458.32
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
Phenoxy compounds Phenol ethers Toluenes Alkyl aryl ethers Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Thioamides Carboxylic acid esters Thiocarboxylic acid amides Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organobromides Organofluorides Organonitrogen compounds Thiocarbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Phenoxy compound - Phenol ether - Alkyl aryl ether - Toluene - Halobenzene - Bromobenzene - Fluorobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Thioamide - Carboxylic acid ester - Ether - Monocarboxylic acid or derivatives - Thiocarboxylic acid amide - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Thiocarbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen 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