Compound Identification
SMILES
[O-][N+]1=CC=C(CC(=O)N2CCN(CC2)[C@@H]2C3=NC=C(Br)C=C3CCC3=CC(Cl)=CC(Br)=C23)C=C1
InChIKey
InChIKey=RKNQPYFCXGJISA-VWLOTQADSA-N
Formula
C25H23Br2ClN4O2
Mass
606.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzocycloheptapyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzocycloheptapyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzocycloheptapyridines
Alternative Parents
Aralkylamines N-alkylpiperazines Pyridinium derivatives Aryl bromides Aryl chlorides Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Carbonyl compounds Organochlorides Organic oxides Organic salts Organobromides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - N-alkylpiperazine - Aralkylamine - Aryl bromide - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Pyridinium - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Organobromide - Organohalogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic salt - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.
External Descriptors
Not available