Compound Identification
SMILES
COC1(CC1)C(=O)NC(C1=CN=CN1C)C1=CC2=C(N=CC=C2)C(O)(C2CCN(CC2)C(=O)OC2CCN(CC2)C(N)=O)C2=C1C=C(Cl)C=C2
InChIKey
InChIKey=ORNWZVVPLHXZMX-UHFFFAOYSA-N
Formula
C36H42ClN7O6
Mass
704.23
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
Piperidinecarboxamides Piperidinecarboxylic acids Aryl chlorides Benzenoids Cyclopropanecarboxylic acids and derivatives N-substituted imidazoles Pyridines and derivatives Carbamate esters Heteroaromatic compounds Tertiary alcohols Ureas Secondary carboxylic acid amides Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - 1-piperidinecarboxamide - Piperidinecarboxamide - Piperidinecarboxylic acid - Aryl chloride - Aryl halide - N-substituted imidazole - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Piperidine - Pyridine - Azole - Imidazole - Heteroaromatic compound - Tertiary alcohol - Carbamic acid ester - Urea - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic nitrogen compound - Organooxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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