Compound Identification
SMILES
CCN1N=CC2=C(NCC3CCCCC3)C3=C(C=CC(OCC(O)=O)=C3)N=C12
InChIKey
InChIKey=WVCOBULLBOKSPD-UHFFFAOYSA-N
Formula
C21H26N4O3
Mass
382.464
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
4-aminoquinolines Pyrazolopyridines Phenol ethers Secondary alkylarylamines Aminopyridines and derivatives Alkyl aryl ethers Pyrazoles Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-aminoquinoline - Aminoquinoline - Phenoxyacetate - Quinoline - Pyrazolopyridine - Phenol ether - Alkyl aryl ether - Aminopyridine - Secondary aliphatic/aromatic amine - Pyridine - Heteroaromatic compound - Azole - Pyrazole - Amino acid or derivatives - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Secondary amine - Amine - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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