Structure Information
Structure

Compound Identification

SMILES

OC1=C2CCCCC2=C(Br)C2=C1C(=O)C1=CC=CC=C1O2

InChIKey

InChIKey=BDIUGXMCGSYLSG-UHFFFAOYSA-N

Formula

C17H13BrO3

Mass

345.192

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Dibenzopyrans - Xanthenes

Direct Parent

Xanthones

Alternative Parents

Naphthopyranones Chromones Tetralins Naphthalenes P-bromophenols Pyranones and derivatives Aryl bromides Vinylogous acids Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Naphthopyranone - Xanthone - Naphthopyran - Chromone - Naphthalene - Tetralin - 4-halophenol - 4-bromophenol - Phenol - Pyranone - Aryl bromide - Aryl halide - Pyran - Benzenoid - Vinylogous acid - Heteroaromatic compound - Oxacycle - Organooxygen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthones. These are polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.

External Descriptors

Not available

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