Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)COC(=O)C2=C(O)C=C(OC)C=C2)SC(CC)=C1
InChIKey
InChIKey=NGUQCVMWFKWTEY-UHFFFAOYSA-N
Formula
C19H21NO7S
Mass
407.44
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
o-Hydroxybenzoic acid esters Methoxyphenols Salicylic acid and derivatives 2,3,5-trisubstituted thiophenes Anisoles Benzoyl derivatives Methoxybenzenes N-arylamides Phenoxy compounds Thiophene carboxylic acids and derivatives Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Heteroaromatic compounds Vinylogous amides Vinylogous acids Carboxylic acid esters Secondary carboxylic acid amides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Methoxyphenol - Benzoate ester - Phenol ether - Phenoxy compound - Thiophene carboxylic acid or derivatives - N-arylamide - 2,3,5-trisubstituted thiophene - Methoxybenzene - Benzoyl - Anisole - 1-hydroxy-4-unsubstituted benzenoid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Vinylogous acid - Vinylogous amide - Thiophene - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - 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