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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cyclohexylphenols
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cyclohexylphenols
Intermediate Tree Nodes
Not available
Direct Parent
Cyclohexylphenols
Alternative Parents
Quinazolines Benzoic acid esters Triazolopyrimidines Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Triazoles Methyl esters Ketones Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides
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