Compound Identification
SMILES
Cl.COC(=O)COC1=CC=C(CC(C)NCC(OC(C)C)C2=CC(Cl)=CC=C2)C=C1
InChIKey
InChIKey=HYQIPFOKNWIRSJ-UHFFFAOYSA-N
Formula
C23H31Cl2NO4
Mass
456.4
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
Amphetamines and derivatives Phenylpropanes Benzylethers Phenoxy compounds Phenol ethers Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl chlorides Methyl esters Amino acids and derivatives Monocarboxylic acids and derivatives Dialkylamines Dialkyl ethers Hydrocarbon derivatives Hydrochlorides Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Amphetamine or derivatives - Benzylether - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Dialkyl ether - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrochloride - Organic oxygen compound - Organic oxide - Organochloride - Hydrocarbon derivative - 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