Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)C1N(C(=O)C2=NNC(C)=C12)C1=CC=C(C)C=C1

InChIKey

InChIKey=QQXYVCDNGJFOJM-UHFFFAOYSA-N

Formula

C21H19N3O3

Mass

361.401

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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

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - 2-heteroaryl carboxamide - Benzoyl - Pyrrolopyrazole - Toluene - Azole - Pyrazole - Pyrrole - Tertiary carboxylic acid amide - Methyl ester - Heteroaromatic compound - Lactam - Carboxylic acid ester - Carboxamide group - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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