Compound Identification
SMILES
OC(=O)[C@@H](C\C=C\C1=CC=CC=C1)OC1=CC=C(Br)C=C1
InChIKey
InChIKey=NNSHNNFMOXAHRT-IEXSPKMKSA-N
Formula
C17H15BrO3
Mass
347.208
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
Styrenes Phenoxy compounds Phenol ethers Medium-chain fatty acids Halogenated fatty acids Bromobenzenes Alkyl aryl ethers Unsaturated fatty acids Aryl bromides Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Phenoxy compound - Medium-chain fatty acid - Styrene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Halogenated fatty acid - Aryl bromide - Aryl halide - Fatty acyl - Fatty acid - Unsaturated fatty acid - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organobromide - Organohalogen compound - Hydrocarbon derivative - 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