Compound Identification
SMILES
[Br-].CC(C)(C)OC(=O)N1CCN(CC2=C[N+](CC#N)=CC=C2)CC1
InChIKey
InChIKey=ILHSTUMRFVFORO-UHFFFAOYSA-M
Formula
C17H25BrN4O2
Mass
397.317
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
- Subclass Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Piperazine carboxylic acids and derivatives
Direct Parent
Piperazine carboxylic acids
Alternative Parents
N-alkylpiperazines Aralkylamines Pyridinium derivatives Heteroaromatic compounds Carbamate esters Trialkylamines Nitriles Azacyclic compounds Organic oxides Organic bromide salts Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperazine-1-carboxylic acid - N-alkylpiperazine - Aralkylamine - Pyridine - Pyridinium - Heteroaromatic compound - Carbamic acid ester - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Azacycle - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic bromide salt - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available