Compound Identification
SMILES
COC1=CC=CC(=C1)N1C=C(C(=O)NC[C@@H]2CCCN3CCCC[C@H]23)C2=CC=CC=C2C1=O
InChIKey
InChIKey=OODMIDWEPSGBEZ-UQBPGWFLSA-N
Formula
C27H31N3O3
Mass
445.563
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Quinolizines Quinolizidines Methoxyanilines Pyridinecarboxylic acids and derivatives Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Pyridinones Piperidines Vinylogous amides Heteroaromatic compounds Lactams Amino acids and derivatives Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Quinolizidine - Quinolizine - Pyridine carboxylic acid or derivatives - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyridinone - Benzenoid - Monocyclic benzene moiety - Piperidine - Pyridine - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Ether - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.
External Descriptors
Not available