Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C(=O)C(=CC1=COC2=C(Cl)C=C(Cl)C=C2C1=O)C#N

InChIKey

InChIKey=OBYJNQJGPAYKOM-UHFFFAOYSA-N

Formula

C17H13Cl2NO3

Mass

350.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Chromones

Alternative Parents

Pyranones and derivatives Benzenoids Aryl chlorides Alpha-branched alpha,beta-unsaturated ketones Heteroaromatic compounds Enones Acryloyl compounds Ketones Oxacyclic compounds Nitriles Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Aldehydes

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Pyranone - Aryl chloride - Aryl halide - Pyran - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Ketone - Oxacycle - Carbonitrile - Nitrile - Organic oxide - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Aldehyde - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.

External Descriptors

Not available

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