Compound Identification
SMILES
CC1=CN=CN1CC1=CC(NC(=O)C2CN(CCN2C(=O)OC2CCCCC2)[C@@H]2C3=C(CCC4=C2N=CC=C4)C=C(Cl)C=C3)=CC=C1
InChIKey
InChIKey=UMHNOLOPPIUQSY-PWXSHKNQSA-N
Formula
C37H41ClN6O3
Mass
653.22
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 Anilides Piperazine carboxylic acids Piperazine carboxamides Imidazolyl carboxylic acids and derivatives N-arylamides Aralkylamines N-alkylpiperazines Pyridines and derivatives Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Piperazine-1-carboxylic acid - Anilide - Imidazolyl carboxylic acid derivative - N-arylamide - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - N-substituted imidazole - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Piperazine - Pyridine - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Carbamic acid ester - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - 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