Compound Identification
SMILES
CCOC1=C(OCC(=O)OC)C=CC(C=C2NC(=O)N(CC3=CC=C(Cl)C=C3)C2=O)=C1
InChIKey
InChIKey=DRBDYINFYLTNOX-UHFFFAOYSA-N
Formula
C22H21ClN2O6
Mass
444.87
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 N-acyl ureas Chlorobenzenes Aryl chlorides Methyl esters Dicarboximides Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydantoin - Phenoxyacetate - Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - N-acyl urea - Ureide - Aryl halide - Aryl chloride - Imidazolidinone - Methyl ester - Imidazolidine - Dicarboximide - Urea - Carboxylic acid ester - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - 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