Compound Identification
SMILES
CC1=CC(C)=C(C=C1)N(CCN1C(=O)C2=CC=CC3=C(C=CC(C1=O)=C23)N1CCCCC1)C(=O)C(C)(C)C
InChIKey
InChIKey=BXBLWMHBWCQSGE-UHFFFAOYSA-N
Formula
C32H37N3O3
Mass
511.666
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 Anilides m-Xylenes Dialkylarylamines Piperidines N-substituted carboxylic acid imides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Anilide - Tertiary aliphatic/aromatic amine - M-xylene - Xylene - Dialkylarylamine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Piperidine - Benzenoid - Carboxylic acid imide - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - 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