Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(N)OC2=C(C1C1=CC=CC=C1)C(=O)CC(C)(C)C2

InChIKey

InChIKey=NBNOTWAEVQQITB-UHFFFAOYSA-N

Formula

C19H21NO4

Mass

327.38

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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 - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Vinylogous amide - Carboxylic acid ester - Ketene acetal or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Aldehyde - Organic nitrogen compound - 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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