Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=DMISVWJYILQPDD-UHFFFAOYSA-N

Formula

C21H18N2O6

Mass

394.383

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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 - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Alkanolamine - Organic oxoazanium - Organic salt - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic zwitterion - 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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