Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(COC2=C(C=CC=C2Br)C2C(=O)OC3=CC=CC=C23)C=C1

InChIKey

InChIKey=FLXBPBJDYVJNHN-UHFFFAOYSA-N

Formula

C22H17BrO4

Mass

425.278

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Coumarans

Subclass

1-phenylcoumarans

Intermediate Tree Nodes

Not available

Direct Parent

1-phenylcoumarans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylcoumaran - Benzofuran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Lactone - Carboxylic acid ester - Ether - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-phenylcoumarans. These are compounds containing a coumaran ring system substituted at the 1-position with phenyl group.

External Descriptors

Not available

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