Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C[C@@H](CC)C2=CC(N(Cl)C3=CC=CC=C3)=C(C=C2C1=O)[N+]([O-])=O

InChIKey

InChIKey=BELOVWWNOIVTOR-CYBMUJFWSA-N

Formula

C21H19ClN2O5

Mass

414.84

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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

2-nitronaphthalene - 2-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid - Nitroaromatic compound - Aryl ketone - Monocyclic benzene moiety - Enoate ester - Alpha,beta-unsaturated carboxylic ester - C-nitro compound - Carboxylic acid ester - Ketone - Organic nitro compound - Organic oxoazanium - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - 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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