Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC=C(C=C1)N=NC1=CC2=C(OC(=O)C(=C2)C(\C)=N\NC(=O)CC(=O)NC2=CC=C(Cl)C=C2)C=C1

InChIKey

InChIKey=XDIFPRCWMHKNKS-YOJSOPRZSA-N

Formula

C28H24ClN5O5

Mass

545.98

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Coumarins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumarin - Benzopyran - 1-benzopyran - Anilide - Phenoxy compound - Phenol ether - N-arylamide - Alkyl aryl ether - Halobenzene - Pyranone - Chlorobenzene - Aryl chloride - Aryl halide - Pyran - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Secondary carboxylic acid amide - Azo compound - Carboxamide group - Lactone - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).

External Descriptors

Not available

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