Compound Identification
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2C3=NC=C(Br)C=C3CCC3=CC(Cl)=CC(Br)=C23)CC1
InChIKey
InChIKey=NVMLZLBFPBHNSZ-MSEJLTFDSA-N
Formula
C40H47Br2ClN4O4
Mass
843.1
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 Amphetamines and derivatives N-acylpiperidines Pyridines and derivatives Aryl bromides Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid amide - Alpha-amino acid or derivatives - Amphetamine or derivatives - N-acyl-piperidine - Aryl bromide - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Pyridine - Piperidine - Heteroaromatic compound - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organochloride - Organonitrogen 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