Compound Identification
SMILES
O[C@@H]1C[C@H](N(CC2=CC(OCC(O)=O)=CC=C2)C1)C1=NC(=C(O1)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=BRVAHNOWLIRUCU-VWNXMTODSA-N
Formula
C28H26N2O5
Mass
470.525
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
Phenyl-1,3-oxazoles Phenylmethylamines Phenoxy compounds Phenol ethers 2,4,5-trisubstituted oxazoles Benzylamines Alkyl aryl ethers Aralkylamines N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Amino acids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,3-oxazole - Phenoxyacetate - Phenol ether - Phenoxy compound - 2,4,5-trisubstituted 1,3-oxazole - Phenylmethylamine - Benzylamine - Alkyl aryl ether - Aralkylamine - N-alkylpyrrolidine - Oxazole - Pyrrolidine - Azole - Heteroaromatic compound - Amino acid or derivatives - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Amino acid - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organic oxide - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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