Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H](SC1=C(N)C=CC(OC2=CC=CC=C2)=C1)[C@@H](O)C(O)=O
InChIKey
InChIKey=KOHHAYZOZFKLSR-RTWAWAEBSA-N
Formula
C22H21NO5S
Mass
411.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Diphenylethers
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylethers
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylethers
Alternative Parents
Diarylethers Phenylpropanoic acids Aniline and substituted anilines Anisoles Thiophenol ethers Methoxybenzenes Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers Monosaccharides Alpha hydroxy acids and derivatives Amino acids Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Primary amines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diphenylether - Diaryl ether - 3-phenylpropanoic-acid - Anisole - Phenol ether - Phenoxy compound - Thiophenol ether - Aniline or substituted anilines - Methoxybenzene - Aryl thioether - Alkylarylthioether - Alkyl aryl ether - Hydroxy acid - Monosaccharide - Alpha-hydroxy acid - Amino acid - Amino acid or derivatives - Secondary alcohol - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Sulfenyl compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Primary amine - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
External Descriptors
Not available