Compound Identification
SMILES
CC(C)(C)OC(=O)C1=CC=C(NC2CCN(CC2)C2=NC=CC=N2)C=C1
InChIKey
InChIKey=GBPWCHIHOHIRMJ-UHFFFAOYSA-N
Formula
C20H26N4O2
Mass
354.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
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
Aminobenzoic acids and derivatives Phenylalkylamines Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Secondary alkylarylamines Aminopyrimidines and derivatives Aminopiperidines Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzoate ester - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Phenylalkylamine - 4-aminopiperidine - Secondary aliphatic/aromatic amine - Aminopyrimidine - Pyrimidine - Piperidine - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organic oxide - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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