Compound Identification
SMILES
CCCN(CCOC1=CC=C(OCC(=O)OC)C=C1)CC(O)COC1=CC=CC2=C1SCCC2
InChIKey
InChIKey=JIDZQTSJQYSFPH-UHFFFAOYSA-N
Formula
C26H35NO6S
Mass
489.63
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
Thiochromanes 1-benzothiopyrans Phenoxy compounds Phenol ethers Alkyl aryl ethers Alkylarylthioethers Thiopyrans Methyl esters 1,2-aminoalcohols Trialkylamines Secondary alcohols Amino acids and derivatives Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - Thiochromane - 1-benzothiopyran - Benzothiopyran - Phenoxy compound - Aryl thioether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Thiopyran - Methyl ester - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Thioether - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Amine - Alcohol - Hydrocarbon derivative - 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