Compound Identification
SMILES
COC1=CC(N)=C(C=C1C(O)=O)S(C)(=O)=O
InChIKey
InChIKey=PGTLUUCBHDLKKY-UHFFFAOYSA-N
Formula
C9H11NO5S
Mass
245.25
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
O-methoxybenzoic acids and derivatives
Alternative Parents
Aminobenzoic acids Methoxyanilines Aminophenyl ethers Benzoic acids Benzenesulfonyl compounds Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Alkyl aryl ethers Sulfones Amino acids Carboxylic acids Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-methoxybenzoic acid or derivatives - Aminobenzoic acid - Aminobenzoic acid or derivatives - Aminophenyl ether - Benzoic acid - Benzenesulfonyl group - Methoxyaniline - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Sulfonyl - Sulfone - Amino acid - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Ether - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Amine - Primary amine - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 2 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available