Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(NCCC[NH+]2CCOCC2)C2=CC=CC=C2OC1=O

InChIKey

InChIKey=OAURYGLBIZQWFI-UHFFFAOYSA-O

Formula

C16H20N3O5

Mass

334.351

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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 - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Pyranone - Morpholine - Benzenoid - Oxazinane - Pyran - Heteroaromatic compound - Quaternary ammonium salt - Vinylogous amide - Tertiary amine - Lactone - C-nitro compound - Organic nitro compound - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Organic salt - 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

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