Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(N\N=C(\C(C)=O)C(=O)NC2=CC=C(C)C=C2)=C(C=C1)C(=O)OC

InChIKey

InChIKey=HTWYMWUHNMQTOO-MOHJPFBDSA-N

Formula

C21H21N3O6

Mass

411.414

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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

Phthalic acid and derivatives - Phthalate esters

Direct Parent

p-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Para-phthalic acid ester - Para_phthalic_acid - Benzoate ester - Anilide - Benzoyl - Phenylhydrazine - N-arylamide - Toluene - Fatty amide - Fatty acyl - Vinylogous amide - Methyl ester - Secondary carboxylic acid amide - Ketone - Carboxylic acid ester - Carboxamide group - Hydrazone - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-phthalate esters. These are ester derivatives of p-phthalic acids, which are based on a benzene 1,4-dicarboxylic acid skeleton.

External Descriptors

Not available

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