Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=NNC2=C(C=C(C)C=C2[N+]([O-])=O)[N+]([O-])=O)C=C1

InChIKey

InChIKey=NLLNZKFNLPRGFW-UHFFFAOYSA-N

Formula

C15H14N4O5

Mass

330.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Nitrotoluenes

Direct Parent

Dinitrotoluenes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Dinitrotoluene - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Phenylhydrazine - Methoxybenzene - Alkyl aryl ether - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrazone - Ether - Organic 1,3-dipolar compound - Organic zwitterion - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic salt - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as dinitrotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and exactly two nitro groups.

External Descriptors

Not available

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