Structure Information
Structure

Compound Identification

SMILES

OC[C@H](N1OC[C@@H]2COC3=C(C=C(C=C3)[N+]([O-])=O)[C@H]12)C1=CC=CC=C1

InChIKey

InChIKey=RPUUYCMHCPNVGG-QANKJYHBSA-N

Formula

C18H18N2O5

Mass

342.351

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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

1-benzopyrans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzopyran - Nitroaromatic compound - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Isoxazolidine - C-nitro compound - Organic nitro compound - Ether - Organic oxoazanium - Oxacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - N-organohydroxylamine - Azacycle - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic zwitterion - Organic oxygen compound - Alcohol - Organopnictogen compound - Organic salt - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.

External Descriptors

Not available

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