Structure Information
Structure

Compound Identification

SMILES

CC1=NON=C1OCCNCCNC1=C(Cl)C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=NHHGMLMHEKPEIK-UHFFFAOYSA-N

Formula

C13H16ClN5O4

Mass

341.75

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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 - Aniline or substituted anilines - Phenylalkylamine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl halide - Aryl chloride - Heteroaromatic compound - Azole - Furazan - Oxadiazole - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic salt - 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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