Compound Identification
SMILES
COC(=O)C1=CC=C(CN(CCCNC(=O)NC2=CC=CC=C2)CCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=AKLCRKFCCCBCCA-UHFFFAOYSA-N
Formula
C27H31N3O3
Mass
445.563
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
-
Subclass
Benzoic acids and derivatives
-
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
N-phenylureas Phenethylamines Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines Methyl esters Ureas Trialkylamines Amino acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - N-phenylurea - Phenethylamine - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Urea - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic 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