Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCC1=CC=C(C=C1)N1C(C)=NN(C1=O)C1=C(C=C(C=C1)C(=O)OC)C(N)=N

InChIKey

InChIKey=KCTOBKRBIBHAFN-UHFFFAOYSA-N

Formula

C22H23N5O5

Mass

437.456

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Carboximidamide - Carboxylic acid derivative - Carboxylic acid amidine - Monocarboxylic acid or derivatives - Amidine - Azacycle - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.

External Descriptors

Not available

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