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Structure Information
Structure

Compound Identification

SMILES

CC1CC(C)(C)NC(CCC2CCCC2=NNC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)O1

InChIKey

InChIKey=CKOSIFGCGRJXKJ-UHFFFAOYSA-N

Formula

C20H29N5O5

Mass

419.482

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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 heteromonocyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Phenylhydrazine - 1,3-oxazinane - Oxazinane - Hemiaminal - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Secondary amine - Hydrazone - Organic oxoazanium - Organic salt - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic 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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