Compound Identification
SMILES
CCOCC(=O)N[C@@H](C1=CN=CN1C)C1=CC2=C(N=CC=C2)[C@@H](N2CCN(CC2)C(=O)OCC2(C)CC2)C2=C1C=C(Cl)C=C2
InChIKey
InChIKey=PPQVJKDJZZESQA-JSOSNVBQSA-N
Formula
C33H39ClN6O4
Mass
619.16
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
Piperazine carboxylic acids Aralkylamines N-alkylpiperazines Pyridines and derivatives Aryl chlorides N-substituted imidazoles Benzenoids Heteroaromatic compounds Carbamate esters Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Piperazine-1-carboxylic acid - Aralkylamine - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Benzenoid - N-substituted imidazole - Pyridine - Piperazine - Azole - Heteroaromatic compound - Carbamic acid ester - Imidazole - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Azacycle - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen 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