Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=CC(NC2=NC=C(C(NC3=C(C=C(O)C=C3)C(O)=O)=N2)[N+]([O-])=O)=CC(OC)=C1OC

InChIKey

InChIKey=VCLQPDIBPALDEZ-UHFFFAOYSA-N

Formula

C20H20ClN5O8

Mass

493.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Hydroxybenzoic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Hydroxybenzoic acid - Benzoic acid - Methoxyaniline - Benzoyl - Phenoxy compound - Aniline or substituted anilines - P-aminophenol - Methoxybenzene - Phenol ether - Anisole - Aminophenol - Nitroaromatic compound - Alkyl aryl ether - Aminopyrimidine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Imidolactam - Pyrimidine - Heteroaromatic compound - Vinylogous amide - C-nitro compound - Organic nitro compound - Amino acid - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxide - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrochloride - Amine - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. These are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups.

External Descriptors

Not available

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