Compound Identification
SMILES
CC(=O)N1CCC(CC(=O)N2CCC(CC2)C2C3=C(CCC4=CC(Br)=C[N+](O)=C24)C=CC=C3Cl)CC1
InChIKey
InChIKey=NJEICIKHNVFQEM-UHFFFAOYSA-N
Formula
C28H34BrClN3O3
Mass
575.95
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
N-acylpiperidines Aryl bromides Aryl chlorides Benzenoids Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Acetamides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organochlorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - N-acyl-piperidine - Aryl bromide - Aryl chloride - Aryl halide - Benzenoid - Piperidine - Pyridinium - Pyridine - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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