Compound Identification
SMILES
CC1=CN(CCCN(CC2=C[N+]([O-])=CC=C2)C(=O)[C@H]2CN(CCN2C(=O)OC2CCCCC2)[C@H]2C3=C(CCC4=C2N=CC=C4)C=C(Cl)C=C3)C=N1
InChIKey
InChIKey=UKYSQDOVSCMBRY-BZFILIQBSA-N
Formula
C39H46ClN7O4
Mass
712.29
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 carboxylic acids Piperazine carboxamides Imidazolyl carboxylic acids and derivatives Aralkylamines N-alkylpiperazines Pyridinium derivatives Aryl chlorides Benzenoids N-substituted imidazoles Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Trialkylamines Azacyclic compounds Organochlorides Carbonyl compounds Organic salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Piperazine-1-carboxylic acid - Imidazolyl carboxylic acid derivative - N-alkylpiperazine - Aralkylamine - Benzenoid - N-substituted imidazole - Aryl chloride - 1,4-diazinane - Pyridinium - Pyridine - Piperazine - Aryl halide - Imidazole - Carbamic acid ester - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic salt - Amine - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - 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