Compound Identification
SMILES
O=C1N\C(=C\C2=CC=CC=C2)C(=O)C2=CC=CC=C12
InChIKey
InChIKey=LYBRXUXQYIYHPT-GXDHUFHOSA-N
Formula
C16H11NO2
Mass
249.269
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass 1,4-isoquinolinediones
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1,4-isoquinolinediones
Intermediate Tree Nodes
Not available
Direct Parent
1,4-isoquinolinediones
Alternative Parents
Isoquinolones and derivatives Tetrahydroisoquinolines Aryl ketones Benzene and substituted derivatives Secondary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,3-dihydroisoquinoline-1,4-dione - Isoquinolone - Tetrahydroisoquinoline - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Ketone - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-isoquinolinediones. These are isoquinoline derivatives carrying a C=O group at positions 1 and 4, respectively.
External Descriptors
Not available