Structure Information
Structure

Compound Identification

SMILES

CC1COC2(O1)N=C(N)C1(C#N)C(C3=CC(=CC=C3)[N+]([O-])=O)C21C#N

InChIKey

InChIKey=NZJXLXPGYMLHMW-UHFFFAOYSA-N

Formula

C16H13N5O4

Mass

339.311

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Tetrahydropyridine - Imidolactam - Meta-dioxolane - Pyrroline - C-nitro compound - Orthocarboxylic acid derivative - Organic nitro compound - Amidine - Carboxylic acid amidine - Carbonitrile - Nitrile - Organic oxoazanium - Carboximidamide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Organoheterocyclic compound - Azacycle - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Organopnictogen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Cyanide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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