Structure Information
Structure

Compound Identification

SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)C(C#N)=C(S)S)[N+]([O-])=O

InChIKey

InChIKey=XWDAUECAVRNWPU-UHFFFAOYSA-N

Formula

C14H10N2O3S2

Mass

318.37

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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

Methoxyanilines Nitroaromatic compounds Anisoles Alkyl aryl ethers Ketene acetals Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Alkylthiols Organic salts Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-nitronaphthalene - Methoxyaniline - Nitroaromatic compound - Anisole - Phenol ether - Alkyl aryl ether - Ketene acetal or derivatives - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Carbonitrile - Nitrile - Alkylthiol - Organic oxoazanium - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Cyanide - Organooxygen compound - Organosulfur compound - Organic oxide - Organic nitrogen compound - Organic salt - 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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