Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(C2C(=O)CCC=C2N1)C1=CC=CS1)C(=O)OC1CCCCCC1

InChIKey

InChIKey=VZPZQMRWOAZGCH-UHFFFAOYSA-N

Formula

C22H27NO3S

Mass

385.52

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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

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