Compound Identification
SMILES
CCOC(=O)CCN1C(C)=NC(=C1Br)[N+]([O-])=O
InChIKey
InChIKey=QHNLWJOCPDJOSH-UHFFFAOYSA-N
Formula
C9H12BrN3O4
Mass
306.116
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Tetrasubstituted imidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles - Tetrasubstituted imidazoles
Direct Parent
1,2,4,5-tetrasubstituted imidazoles
Alternative Parents
Imidazolyl carboxylic acids and derivatives Nitroaromatic compounds Nitroimidazoles Aryl bromides Imidolactams N-substituted imidazoles Heteroaromatic compounds Carboxylic acid esters Organic oxoazanium compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organic salts Organobromides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,2,4,5-tetrasubstituted imidazole - Nitroaromatic compound - Imidazolyl carboxylic acid derivative - Nitroimidazole - Aryl bromide - Aryl halide - N-substituted imidazole - Imidolactam - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Hydrocarbon derivative - Organic salt - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organobromide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2,4,5-tetrasubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at for positions 1,2,4, and 5.
External Descriptors
Not available