Compound Identification
SMILES
[H]C1(CN=C(O)C2=CN(CC3=CC=CC=C3)C(=O)C3=CC=CC=C23)CCCN2CCCCC12[H]
InChIKey
InChIKey=SJWVKPJGYIXVJM-UHFFFAOYSA-N
Formula
C27H31N3O2
Mass
429.564
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 Pyridinones Piperidines Benzene and substituted derivatives Heteroaromatic compounds Trialkylamines Lactams Propargyl-type 1,3-dipolar organic compounds Carboximidic acids Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Quinolizidine - Quinolizine - Pyridinone - Monocyclic benzene moiety - Piperidine - Pyridine - Benzenoid - Heteroaromatic compound - Lactam - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Azacycle - Carboximidic acid derivative - Carboximidic acid - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - 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