Structure Information
Structure

Compound Identification

SMILES

CCCOC(=O)C1=C(C)NC2=C(C1C1=CN=CC=C1)C(=O)CC(C)(C)C2

InChIKey

InChIKey=MDJAZZVPALFEBH-UHFFFAOYSA-N

Formula

C21H26N2O3

Mass

354.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dihydropyridine - Cyclohexenone - Pyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Enamine - Secondary aliphatic amine - Organoheterocyclic compound - Azacycle - Amine - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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