Compound Identification
SMILES
COC(=O)C1=CC(SC)=C(OC)C=C1N
InChIKey
InChIKey=WTNFCYJPAFQNSB-UHFFFAOYSA-N
Formula
C10H13NO3S
Mass
227.28
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
Aminobenzoic acids and derivatives Benzoic acid esters M-sulfanylbenzoic acids and derivatives Aminophenyl ethers Methoxyanilines Methoxybenzenes Benzoyl derivatives Thiophenol ethers Anisoles Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers Methyl esters Vinylogous amides Amino acids and derivatives Sulfenyl compounds Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - M-sulfanylbenzoic acid or derivatives - Benzoate ester - Aminobenzoic acid or derivatives - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Phenol ether - Benzoyl - Thiophenol ether - Aryl thioether - Aniline or substituted anilines - Anisole - Methoxybenzene - Alkylarylthioether - Alkyl aryl ether - Vinylogous amide - Methyl ester - Carboxylic acid ester - Amino acid or derivatives - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Primary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen 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