Compound Identification
SMILES
ClC1=CC(Br)=C2[C@@H](C3CCN(CC3)C(=O)CON=C3CCC4(CC3)OCCO4)C3=NC=C(Br)C=C3CCC2=C1
InChIKey
InChIKey=VDLCOKJBAJVNBY-HHHXNRCGSA-N
Formula
C29H32Br2ClN3O4
Mass
681.85
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 Ketals Aryl bromides Aryl chlorides Benzenoids Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds 1,3-dioxolanes Oxime ethers Azacyclic compounds Oxacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - N-acyl-piperidine - Ketal - Aryl bromide - Aryl chloride - Aryl halide - Piperidine - Benzenoid - Pyridine - Meta-dioxolane - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Oxime ether - Oxacycle - Acetal - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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