Compound Identification
SMILES
OC(Cl)C(Br)[N+]([O-])=O
InChIKey
InChIKey=JKZXWPQETTZSMQ-UHFFFAOYSA-N
Formula
C2H3BrClNO3
Mass
204.4
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
- Level 5 C-nitro compounds
-
Subclass
Organic nitro compounds
-
Class
Allyl-type 1,3-dipolar organic compounds
-
Superclass
Organic 1,3-dipolar compounds
Kingdom
Organic compounds
Superclass
Organic 1,3-dipolar compounds
Class
Allyl-type 1,3-dipolar organic compounds
Subclass
Organic nitro compounds
Intermediate Tree Nodes
Not available
Direct Parent
C-nitro compounds
Alternative Parents
Bromohydrins Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Organochlorides Organobromides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides Alcohols and polyols
Molecular Framework
Aliphatic acyclic compounds
Substituents
Bromohydrin - Halohydrin - C-nitro compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Alcohol - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Alkyl bromide - Organic salt - Hydrocarbon derivative - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as c-nitro compounds. These are compounds having the nitro group, -NO2 (free valence on nitrogen), which is attached to carbon.
External Descriptors
Not available