Compound Identification
SMILES
COC1=C(OCC2=CC=CC=C2)C=C(C(O)=O)C(SC2=CC=CC=C2)=C1
InChIKey
InChIKey=LBEFHXSUGRRIBW-UHFFFAOYSA-N
Formula
C21H18O4S
Mass
366.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Methoxybenzoic acids and derivatives
Direct Parent
P-methoxybenzoic acids and derivatives
Alternative Parents
Diarylthioethers O-sulfanylbenzoic acids Benzoic acids Thiophenol ethers Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Alkyl aryl ethers Vinylogous thioesters Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diarylthioether - P-methoxybenzoic acid or derivatives - O-sulfanylbenzoic acid or derivatives - O-sulfanylbenzoic acid - Benzoic acid - Phenoxy compound - Aryl thioether - Methoxybenzene - Thiophenol ether - Phenol ether - Benzoyl - Anisole - Alkyl aryl ether - Vinylogous thioester - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available