Compound Identification
SMILES
Br.CC12CC3(C)CC(N)(C1)CC(CO[N+]([O-])=O)(C2)C3
InChIKey
InChIKey=JBCBJVQYVJHSNM-UHFFFAOYSA-N
Formula
C13H23BrN2O3
Mass
335.242
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organic oxoanionic compounds
-
Subclass
Organic nitrates
- Level 5 Alkyl nitrates
-
Subclass
Organic nitrates
-
Class
Organic oxoanionic compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organic oxoanionic compounds
Subclass
Organic nitrates
Intermediate Tree Nodes
Not available
Direct Parent
Alkyl nitrates
Alternative Parents
Organic nitro compounds Organic nitric acids and derivatives Organooxygen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Hydrobromides Organic cations
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Alkyl nitrate - Organic nitric acid or derivatives - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrobromide - Organic salt - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Organic cation - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl nitrates. These are organic compounds containing a nitrate that is O-linked to an alkyl group.
External Descriptors
Not available