Structure Information
Structure

Compound Identification

SMILES

COC1(C)CC(C2C(O1)C1=CC=CC=C1OC2=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=YQUIWPSUNFBSHT-UHFFFAOYSA-N

Formula

C20H19NO6

Mass

369.373

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

3,4-dihydrocoumarins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

3,4-dihydrocoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3,4-dihydrocoumarin - Chromane - Benzopyran - 1-benzopyran - Nitrobenzene - Nitroaromatic compound - Ketal - Monocyclic benzene moiety - Oxane - Benzenoid - Carboxylic acid ester - Lactone - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Acetal - Monocarboxylic acid or derivatives - Organic salt - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3,4-dihydrocoumarins. These are 3,4-dihydrogenated coumarins. Coumarin is a bicyclic compound that a 1-benzopyran carrying an oxo group at the 2-position.

External Descriptors

Not available

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