Compound Identification
SMILES
CCOC(=O)C1=CC=CC=C1CC(=O)[C@]1(CCC2=CC3=C(C=C(C=C3)C(N)=N)N2CC)CCCN1
InChIKey
InChIKey=CMZNAGDATGQXKR-MUUNZHRXSA-N
Formula
C28H34N4O3
Mass
474.605
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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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-alkylindoles Indoles Benzoyl derivatives Aralkylamines Substituted pyrroles Pyrrolidines Heteroaromatic compounds Alpha-amino ketones Carboxylic acid esters Amino acids and derivatives Dialkylamines Carboximidamides Carboxamidines Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - Benzoate ester - Indole - Indole or derivatives - Benzoyl - Aralkylamine - Substituted pyrrole - Alpha-aminoketone - Pyrrole - Pyrrolidine - Heteroaromatic compound - Carboxylic acid ester - Amino acid or derivatives - Ketone - Secondary amine - Secondary aliphatic amine - Carboxylic acid amidine - Amidine - Carboxylic acid derivative - Carboximidamide - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic 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