Structure Information
Structure

Compound Identification

SMILES

CC12C(C3=CC=CC=C3)C(Br)([N+]([O-])=O)C(C)(C1=O)C(=C2C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=XHSXCOYMXSQUDC-UHFFFAOYSA-N

Formula

C27H22BrNO3

Mass

488.381

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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 homopolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Stilbene - Monocyclic benzene moiety - Benzenoid - Ketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organopnictogen compound - Organohalogen compound - Alkyl halide - Organic oxygen compound - Alkyl bromide - Carbonyl group - Organic nitrogen compound - Organic oxide - Aromatic homopolycyclic 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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