Compound Identification
SMILES
COC(=O)CCCN1C(C)=CC(C(=O)COC(=O)C2=C(O)C=C(OC)C=C2)=C1C
InChIKey
InChIKey=AVLDOXMKUNHGOI-UHFFFAOYSA-N
Formula
C21H25NO7
Mass
403.431
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 Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Fatty acid methyl esters Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Substituted pyrroles Methyl esters Vinylogous amides Heteroaromatic compounds Vinylogous acids Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Methoxyphenol - Benzoate ester - Anisole - Benzoyl - Phenoxy compound - Methoxybenzene - Phenol ether - Aryl alkyl ketone - Aryl ketone - Phenol - Fatty acid ester - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Fatty acid methyl ester - Fatty acyl - Substituted pyrrole - Vinylogous acid - Pyrrole - Vinylogous amide - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - 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