Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=NNC2=NC(NC3=CC=C(C=C3)[N+]([O-])=O)=NC(NC3=CC(C)=C(C)C=C3)=N2)C=C(Br)C=C1

InChIKey

InChIKey=DSMQTJUWPSJANJ-UHFFFAOYSA-N

Formula

C25H23BrN8O3

Mass

563.416

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 - Phenoxy compound - 2,4-diamine-s-triazine - Nitroaromatic compound - O-xylene - Xylene - Anisole - Methoxybenzene - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - 1,3,5-triazine - Triazine - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Ether - Azacycle - Organic oxoazanium - Hydrazone - Organic zwitterion - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic salt - 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