Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(OC3=C(C(N(C4=NC=CS4)C3=O)C3=CC(=CC=C3)[N+]([O-])=O)C2=O)C=C1

InChIKey

InChIKey=CJUCLCWGUJKCHS-UHFFFAOYSA-N

Formula

C21H13N3O5S

Mass

419.41

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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 - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - 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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