Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](CCC1=C(C2=CC=CC=C2C=C1)[N+]([O-])=O)\C=N/O

InChIKey

InChIKey=XQWSJPCPBUEAOY-OMJMQIJPSA-N

Formula

C16H16N2O5

Mass

316.313

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Nitronaphthalenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitronaphthalenes

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-nitronaphthalene - Nitroaromatic compound - Fatty acid ester - Fatty acyl - Methyl ester - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Aldoxime - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Oxime - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic salt - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.

External Descriptors

Not available

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