Compound Identification
SMILES
OC(=O)C(O)=O.BrC1=CC=CC=C1CN1CCN(CC1)C(=O)C1=CN=CC=C1
InChIKey
InChIKey=UGUGNMZKLNBHCP-UHFFFAOYSA-N
Formula
C19H20BrN3O5
Mass
450.289
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids and derivatives
Alternative Parents
Benzylamines Phenylmethylamines Aralkylamines Bromobenzenes N-alkylpiperazines Aryl bromides Dicarboxylic acids and derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Pyridine carboxylic acid or derivatives - Phenylmethylamine - Benzylamine - Aralkylamine - N-alkylpiperazine - Halobenzene - Bromobenzene - 1,4-diazinane - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Piperazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Carboxylic acid derivative - Azacycle - Carboxylic acid - Amine - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
External Descriptors
Not available