Compound Identification
SMILES
COP(=O)(C#CC)C(O)(CBr)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=PZCBTWKZGNGUHH-UHFFFAOYSA-N
Formula
C12H13BrNO5P
Mass
362.116
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Nitroaromatic compounds Phosphinic acid esters Bromohydrins Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Organobromides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Aromatic alcohols Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Bromohydrin - Halohydrin - C-nitro compound - Phosphinic acid ester - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Aromatic alcohol - Alkyl bromide - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organic zwitterion - Organohalogen compound - Organic nitrogen compound - Organic salt - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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