Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)[C@H]1[C@H]2C(=O)C[C@@H](CC2=NC2=NC=NN12)C1=CC=CC=C1O

InChIKey

InChIKey=IZSDUXJEZHPFJA-LPTQZCDUSA-N

Formula

C23H20N4O4

Mass

416.437

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Cyclohexylphenols

Intermediate Tree Nodes

Not available

Direct Parent

Cyclohexylphenols

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclohexylphenol - Benzoate ester - Quinazoline - Benzoic acid or derivatives - Triazolopyrimidine - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidine - Heteroaromatic compound - Azole - Methyl ester - 1,2,4-triazole - Triazole - Carboxylic acid ester - Ketimine - Ketone - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Imine - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexylphenols. These are compounds containing a cyclohexane lined to a phenol group.

External Descriptors

Not available

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