Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(C=C1)[C@@H]1CC(O)=C2C(=O)CC(C)(C)C=C2C1(C#N)C#N

InChIKey

InChIKey=YPORZJJBOCXJSY-INIZCTEOSA-N

Formula

C22H22N2O2

Mass

346.43

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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 homopolycyclic compounds

Substituents

Cyclohexenone - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Nitrile - Carbonitrile - Enol - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homopolycyclic 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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