Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(C=C1)[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2

InChIKey

InChIKey=JQCFNWBYDZHEDG-INIZCTEOSA-N

Formula

C18H18N2O2

Mass

294.354

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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

Cyclohexenone - Monocyclic benzene moiety - Pyran - Benzenoid - Vinylogous ester - Ketene acetal or derivatives - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Primary aliphatic amine - 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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