Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1NC1=NC=NC(NC2=CC=C(Cl)C=C2)=C1[N+]([O-])=O

InChIKey

InChIKey=JMXRPPHMKRQSBA-UHFFFAOYSA-N

Formula

C17H14ClN5O2

Mass

355.78

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aniline or substituted anilines - Nitroaromatic compound - Aminopyrimidine - Chlorobenzene - Halobenzene - Toluene - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Aryl chloride - Benzenoid - Imidolactam - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organochloride - Organonitrogen compound - Organohalogen compound - Amine - Hydrocarbon derivative - Organic salt - Organic oxide - Organic zwitterion - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

Previous Back Next