Structure Information
Structure

Compound Identification

SMILES

[I-].C[N+]1(CCC(C=CC2=CC=C(C=C2)[N+]([O-])=O)=NO)CCOCC1

InChIKey

InChIKey=HJQYCTVVUQHEAE-UHFFFAOYSA-N

Formula

C16H22IN3O4

Mass

447.273

Export to:

JSON SDF CSV

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 - Styrene - Morpholine - Oxazinane - Tetraalkylammonium salt - Ketoxime - Quaternary ammonium salt - C-nitro compound - Organic nitro compound - Dialkyl ether - Ether - Organic oxoazanium - Oxime - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic iodide salt - Organic zwitterion - Organic oxide - Amine - Organonitrogen compound - Organic salt - Organooxygen compound - 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

Previous Back Next