Compound Identification
SMILES
ClC1=CC(Br)=C2C(C3CCN(CC3)C(=O)CN3CCC4(CC3)OCCO4)C3=NC=C(Br)C=C3CCC2=C1
InChIKey
InChIKey=NSGJRQIYFVCSOI-UHFFFAOYSA-N
Formula
C28H32Br2ClN3O3
Mass
653.84
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
Alpha amino acids and derivatives Azaspirodecane derivatives N-acylpiperidines Ketals Pyridines and derivatives Benzenoids Aryl chlorides Aryl bromides 1,3-dioxolanes Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Azaspirodecane - N-acyl-piperidine - Ketal - Aryl bromide - Aryl chloride - Aryl halide - Piperidine - Pyridine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Meta-dioxolane - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Oxacycle - Acetal - Azacycle - Carboxylic acid derivative - Amine - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - 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