Compound Identification
SMILES
CC1=CC=C(CCCC2(O)CCN(CCN3C(O)C4=CC=CC5=C4C(=CC=C5)C3=O)CC2)C=C1
InChIKey
InChIKey=CQJZIZGTAPWUAD-UHFFFAOYSA-N
Formula
C29H34N2O3
Mass
458.602
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
Naphthalenes Toluenes Aralkylamines Piperidines Tertiary carboxylic acid amides Tertiary alcohols Trialkylamines Lactams Amino acids and derivatives Azacyclic compounds Alkanolamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Toluene - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Tertiary carboxylic acid amide - Tertiary alcohol - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Carboxamide group - Lactam - Azacycle - Alkanolamine - Carboxylic acid derivative - Organic nitrogen compound - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organooxygen compound - Organic oxygen compound - Organonitrogen 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