Compound Identification
SMILES
O=C(C1CC1)N1CC(C1)NC1=C2C=NC=CC2=CC(=C1)C1=CC=CC(=C1)C#N
InChIKey
InChIKey=LXCZBXZJNGXSLQ-UHFFFAOYSA-N
Formula
C23H20N4O
Mass
368.44
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
Benzonitriles Secondary alkylarylamines Pyridines and derivatives Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Azetidines Amino acids and derivatives Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Benzonitrile - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Pyridine - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Azetidine - Carboxamide group - Tertiary amine - Carboxylic acid derivative - Azacycle - Secondary amine - Carbonitrile - Nitrile - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Cyanide - Organonitrogen compound - Organooxygen compound - 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