Compound Identification
SMILES
[O-]C(=O)COC1=C(C=C2NC(=O)N(CC3=CC=CC=C3F)C2=O)C=C(Br)C=C1
InChIKey
InChIKey=XIBQULLGRCWDEZ-UHFFFAOYSA-M
Formula
C19H13BrFN2O5
Mass
448.225
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
Hydantoins Alpha amino acids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Bromobenzenes N-acyl ureas Fluorobenzenes Aryl bromides Aryl fluorides Dicarboximides Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organofluorides Organonitrogen compounds Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydantoin - Phenoxyacetate - Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - N-acyl urea - Alkyl aryl ether - Halobenzene - Ureide - Fluorobenzene - Bromobenzene - Imidazolidinone - Aryl bromide - Aryl fluoride - Aryl halide - Imidazolidine - Dicarboximide - Urea - Carbonic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Carbonyl group - Organobromide - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic anion - Aromatic heteromonocyclic 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