Compound Identification
SMILES
BrC1=CC=CC(=C1)N1C2C=CC3=C(C2=O)C(=C(NCC2=CC=CC=N2)C=C3)C1=O
InChIKey
InChIKey=FJMOWTHHNRWTIX-UHFFFAOYSA-N
Formula
C23H16BrN3O2
Mass
446.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
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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
Tetrahydroisoquinolines Naphthalenes 2-pyridylmethylamines Aryl alkyl ketones Secondary alkylarylamines Aralkylamines Bromobenzenes Aryl bromides Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Tetrahydroisoquinoline - 2-pyridylmethylamine - Aryl ketone - Aryl alkyl ketone - Halobenzene - Secondary aliphatic/aromatic amine - Bromobenzene - Aralkylamine - Aryl bromide - Aryl halide - Pyridine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Ketone - Carboxamide group - Lactam - Azacycle - Secondary amine - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - 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