Structure Information
Structure

Compound Identification

SMILES

[O-][N+]([O-])=O.COC1=CC2=C(C=C1)C=C(C=C2)[C@H](C)C(=O)OCC1=NC(CO[N+]([O-])=O)=CC=C1

InChIKey

InChIKey=XSBFGEATQPOQHM-UQKRIMTDSA-N

Formula

C21H20N3O9

Mass

458.404

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Naphthalene - Anisole - Phenol ether - Alkyl aryl ether - Pyridine - Heteroaromatic compound - Organic nitrate - Alkyl nitrate - Carboxylic acid ester - Organic nitro compound - Organic nitric acid - Organic nitric acid or derivatives - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.

External Descriptors

Not available

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