Compound Identification
SMILES
CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(OC(C(O)=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=MKACSYZXWJESRL-UHFFFAOYSA-N
Formula
C23H25ClN2O4
Mass
428.91
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
1,2,4,5-tetrasubstituted imidazoles Phenoxy compounds Phenol ethers Imidazolyl carboxylic acids and derivatives Alkyl aryl ethers Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Primary alcohols Organochlorides Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - 1,2,4,5-tetrasubstituted imidazole - Phenoxy compound - Imidazolyl carboxylic acid derivative - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - N-substituted imidazole - Heteroaromatic compound - Imidazole - Azole - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - 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