Compound Identification
SMILES
[O-][N+](=O)NC1=NCCN1CC1=CN=C(Br)C=C1
InChIKey
InChIKey=CDSIGHUKOXXMJF-UHFFFAOYSA-N
Formula
C9H10BrN5O2
Mass
300.116
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
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Subclass
Guanidines
- Level 5 Nitroguanidines
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Subclass
Guanidines
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Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Guanidines
Intermediate Tree Nodes
Not available
Direct Parent
Nitroguanidines
Alternative Parents
2-halopyridines Aryl bromides Nitramines Imidazolines Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organobromides Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroguanidine - 2-halopyridine - Aryl bromide - Aryl halide - Pyridine - 2-imidazoline - Heteroaromatic compound - Nitramine - Organic nitro compound - Azacycle - Organoheterocyclic compound - Carboximidamide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxygen compound - Organobromide - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitroguanidines. These are organonitrogen compounds containing a nitro group, which is N-linked to a guanidine.
External Descriptors
Not available