Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)OC[C@@H]1COC(C[S@@](=O)C2=CC=C(C)C=C2)=CC1
InChIKey
InChIKey=OHBRQIBGLVWUTP-YMGMXPECSA-N
Formula
C22H24O5S
Mass
400.49
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
Benzoic acid esters Phenyl sulfoxides Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Toluenes Alkyl aryl ethers Sulfoxides Carboxylic acid esters Sulfinyl compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - Benzoate ester - Phenyl sulfoxide - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Toluene - Alkyl aryl ether - Sulfoxide - Carboxylic acid ester - Sulfinyl compound - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic 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