Compound Identification
SMILES
COCC(C)N1C(C)=CC(C(=O)COC(=O)C2=CC=C(C=C2)C#N)=C1C
InChIKey
InChIKey=RJQBKFGQFSSITB-UHFFFAOYSA-N
Formula
C20H22N2O4
Mass
354.406
Taxonomic Classification
Taxonomy Tree
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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
-
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
Benzoyl derivatives Benzonitriles Aryl alkyl ketones Substituted pyrroles Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Nitriles Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzonitrile - Benzoyl - Aryl alkyl ketone - Aryl ketone - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Vinylogous amide - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - 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