Structure Information
Structure

Compound Identification

SMILES

OC1=C(F)C=CC2=C1C1=C(C=C(C=C1)[N+]([O-])=O)C(=O)O2

InChIKey

InChIKey=CWDPTRNQRRAEOQ-UHFFFAOYSA-N

Formula

C13H6FNO5

Mass

275.191

Export to:

JSON SDF CSV

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 - Isocoumarin - Benzopyran - 1-benzopyran - 2-benzopyran - 2-halophenol - Nitroaromatic compound - 2-fluorophenol - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Pyranone - Aryl fluoride - Aryl halide - Benzenoid - Pyran - Heteroaromatic compound - Organic nitro compound - Lactone - C-nitro compound - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic cation - 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

Previous Back Next