Compound Identification
SMILES
CC(C)(C)OC(=O)N1CCC(CC1C(=O)N(CCCN1C=CN=C1)CC1=CC=CC=C1)[C@H]1C2=C(CCC3=CC(Br)=CN=C13)C=C(Cl)C=C2
InChIKey
InChIKey=HKDABSDCIHMSRA-FKWDAJKLSA-N
Formula
C38H43BrClN5O3
Mass
733.15
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 acid amides Piperidinecarboxamides Piperidinecarboxylic acids Aryl bromides Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles Pyridines and derivatives Heteroaromatic compounds Carbamate esters Tertiary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid amide - Alpha-amino acid or derivatives - Piperidinecarboxylic acid - Piperidinecarboxamide - 2-piperidinecarboxamide - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Pyridine - Piperidine - Heteroaromatic compound - Azole - Carbamic acid ester - Imidazole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organobromide - 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