Compound Identification
SMILES
CC1=CC(C(=O)C[N+]2=CC3=CC=CC=C3C=C2)=C(C)N1CC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=PJPKCWHNXDZIQB-UHFFFAOYSA-N
Formula
C25H23N2O3
Mass
399.469
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Benzodioxoles Aryl alkyl ketones Substituted pyrroles Pyridinium derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Acetals Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organopnictogen compounds Aldehydes Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Benzodioxole - Aryl alkyl ketone - Aryl ketone - Pyridine - Benzenoid - Pyridinium - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Ketone - Acetal - Oxacycle - Azacycle - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available