Compound Identification
SMILES
CCC1=NC=CN1CCCN(CC1=CC=CC=C1)C(=O)[C@H]1CN(CCN1C(=O)OC1CCCCC1)C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2
InChIKey
InChIKey=FGRCPRJSIPFTHS-UGLVAYHUSA-N
Formula
C41H49ClN6O3
Mass
709.33
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 Piperazine carboxamides Piperazine carboxylic acids Aralkylamines N-alkylpiperazines N-substituted imidazoles Benzene and substituted derivatives Aryl chlorides Pyridines and derivatives Heteroaromatic compounds Carbamate esters Tertiary carboxylic acid amides Trialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Piperazine-1-carboxylic acid - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - N-substituted imidazole - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Piperazine - Pyridine - Benzenoid - Imidazole - Tertiary carboxylic acid amide - Carbamic acid ester - Heteroaromatic compound - Azole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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