Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OC)=C2C(CCC(NC(C)=O)C3=CC(=O)C(NC4=CC(Cl)=C(F)C=C4)=CC=C23)=C1

InChIKey

InChIKey=SPBGYIZVWUKLJA-UHFFFAOYSA-N

Formula

C27H26ClFN2O5

Mass

512.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Hydrocarbon derivatives

Class

Tropones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tropones

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Anisole - Aniline or substituted anilines - Tropone - Phenol ether - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Acetamide - Amino acid or derivatives - Cyclic ketone - Secondary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid derivative - Secondary amine - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tropones. These are compounds containing a tropone ring, which is a cycloheptatrienone ring bearing a ketone group.

External Descriptors

Not available

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