Compound Identification
SMILES
CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)[C@@H]1[C@H](C(O)=O)C2=CC=CC=C2C(=O)N1C1=CC=CC=C1F
InChIKey
InChIKey=CYXGVRFMIZAUIO-DNQXCXABSA-N
Formula
C28H27BFNO5
Mass
487.33
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
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 Fluorobenzenes Aryl fluorides Tertiary carboxylic acid amides Boronic acid esters Dioxaborolanes Lactams Oxacyclic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic metalloid salts Organometalloid compounds Organofluorides Hydrocarbon derivatives Organic oxides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Tetrahydroisoquinoline - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Boronic acid ester - 1,3,2-dioxaborolane - Tertiary carboxylic acid amide - Boronic acid derivative - Carboxamide group - Lactam - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organic metalloid salt - Monocarboxylic acid or derivatives - Organic metalloid moeity - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - 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