Compound Identification
SMILES
COC1=C(SC2=C(C)N(C3=C2C=CC(Cl)=C3)C2=CN=CC=C2)C=C(C=C1)C(O)=O
InChIKey
InChIKey=UAXOMDMNGHFVHC-UHFFFAOYSA-N
Formula
C22H17ClN2O3S
Mass
424.9
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 M-sulfanylbenzoic acids Benzoic acids Indoles Anisoles Thiophenol ethers Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyridines and derivatives Substituted pyrroles Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - Diarylthioether - M-sulfanylbenzoic acid or derivatives - M-sulfanylbenzoic acid - Benzoic acid - Indole - Indole or derivatives - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Benzoyl - Thiophenol ether - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Pyridine - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic 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