Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=C(C)C=C1)S(=O)(=O)N1CCC2(CCN(C2)C(=O)CCC(=O)C2=CC3=C(OCCCO3)C=C2)CC1

InChIKey

InChIKey=KLKPPHSSUQVDQO-UHFFFAOYSA-N

Formula

C29H36N2O6S

Mass

540.68

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Butyrophenones

Intermediate Tree Nodes

Not available

Direct Parent

Butyrophenones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Butyrophenone - Azaspirodecane - Benzenesulfonamide - Benzenesulfonyl group - Aryl ketone - Aryl alkyl ketone - N-acylpyrrolidine - Xylene - P-xylene - Alkyl aryl ether - Piperidine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Pyrrolidine - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Ketone - Carboxamide group - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.

External Descriptors

Not available

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