Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C(=O)C1CCCN(C1)C(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

InChIKey

InChIKey=OFNZCZWHPZPRMF-UHFFFAOYSA-N

Formula

C21H29N3O6

Mass

419.478

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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

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Benzoate ester - N-phenylurea - 1-piperidinecarboxamide - 3-piperidinecarboxamide - Piperidinecarboxamide - Benzoyl - Piperidine - Methyl ester - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Urea - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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