Compound Identification
SMILES
CCOC(=O)C(CC1=CC=C(OCCN(C)C2=NC3=CC=CC=C3O2)C=C1)OC1=CC=CC=C1
InChIKey
InChIKey=HAGFROOQVMDTCZ-UHFFFAOYSA-N
Formula
C27H28N2O5
Mass
460.53
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
Benzoxazoles Phenoxy compounds Phenol ethers Dialkylarylamines Alkyl aryl ethers Fatty acid esters Oxazoles Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - Benzoxazole - Phenoxy compound - Phenol ether - Dialkylarylamine - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Azole - Oxazole - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic 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