Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(=C1)N1C(C)=CC(\C=N/NC2=NC(C)=CC(C)=N2)=C1C)C(=O)OC

InChIKey

InChIKey=WAVXGCIMYJILPD-MSXFZWOLSA-N

Formula

C23H25N5O4

Mass

435.484

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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 - 1-phenylpyrrole - Benzoate ester - Benzoyl - Pyrimidine - Substituted pyrrole - Heteroaromatic compound - Methyl ester - Pyrrole - Carboxylic acid ester - Carboxylic acid derivative - Hydrazone - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - 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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