Structure Information
Structure

Compound Identification

SMILES

CC1=CSC(=N1)N1C(C2=C(OC3=C(C=C(Cl)C=C3)C2=O)C1=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=HUKORXNWGDLELI-UHFFFAOYSA-N

Formula

C21H12ClN3O5S

Mass

453.85

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Nitrobenzene - 2-heteroaryl carboxamide - Nitroaromatic compound - 2,4-disubstituted 1,3-thiazole - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Organic zwitterion - Organic oxygen compound - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - 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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