Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.BrC1=C(Br)N=CC(=C1)N1C[C@@H]2CN[C@@H]2C1
InChIKey
InChIKey=CTNQMZIJVPAYLJ-JZWNBYOFSA-N
Formula
C14H15Br2N3O4
Mass
449.099
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Halopyridines
- Level 5 Polyhalopyridines
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Subclass
Halopyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Halopyridines
Intermediate Tree Nodes
Not available
Direct Parent
Polyhalopyridines
Alternative Parents
Dialkylarylamines 1,4-diazepanes 2-halopyridines Aminopyridines and derivatives Unsaturated fatty acids Dicarboxylic acids and derivatives Aryl bromides Pyrrolidines Heteroaromatic compounds Azetidines Dialkylamines Azacyclic compounds Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Tertiary aliphatic/aromatic amine - Dialkylarylamine - Polyhalopyridine - 1,4-diazepane - Aminopyridine - 2-halopyridine - Diazepane - Dicarboxylic acid or derivatives - Aryl bromide - Aryl halide - Unsaturated fatty acid - Fatty acyl - Fatty acid - Heteroaromatic compound - Pyrrolidine - Tertiary amine - Azetidine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Secondary amine - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by a halogen atom.
External Descriptors
Not available