Compound Identification
SMILES
CC12CCC(CCOC3=CC=CC4=C3C=CN=C4)(O1)C1C2C(=O)N(C1=O)C1=C(C#N)C2=CC=CC=C2C=C1
InChIKey
InChIKey=MSDFWNYUDCWRJP-UHFFFAOYSA-N
Formula
C31H25N3O4
Mass
503.558
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
Isoindolones Naphthalenes Phenol ethers Alkyl aryl ethers Pyrrolidine-2-ones Pyridines and derivatives N-substituted carboxylic acid imides Oxolanes Dicarboximides Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - Isoquinoline - Naphthalene - Isoindoline - Isoindole or derivatives - Phenol ether - Alkyl aryl ether - Carboxylic acid imide, n-substituted - Pyridine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Carboxylic acid imide - Pyrrolidine - Oxolane - Dicarboximide - Heteroaromatic compound - Lactam - Azacycle - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Nitrile - Carbonitrile - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - 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