Structure Information
Structure

Compound Identification

SMILES

OC1(CC(C2=CC=C(OC(F)F)C=C2)=[N+]2CCCCCN12)C1=CC=C(C=C1)C1=CC=CC=C1

InChIKey

InChIKey=CRPKMIAWFVKDJR-UHFFFAOYSA-N

Formula

C27H27F2N2O2

Mass

449.521

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Biphenyl - Phenoxy compound - Phenol ether - 1,2-diazepane - Diazepane - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Organoheterocyclic compound - Azacycle - Alkanolamine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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