Compound Identification
SMILES
[O-]C(=O)C(F)(F)F.COC1=CC(OC)=C2C(C[C@H](C)[N+](=C2C)C2=C3C=C(C)C=C(OC)C3=C(OC)C=C2)=C1
InChIKey
InChIKey=HZFBKINLKVUVQX-NTISSMGPSA-M
Formula
C28H30F3NO6
Mass
533.544
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Naphthylisoquinolines
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Naphthylisoquinolines
Intermediate Tree Nodes
Not available
Direct Parent
Naphthylisoquinolines
Alternative Parents
Naphthalenes Dihydroisoquinolines Methoxyanilines Anisoles Alkyl aryl ethers Alpha-halocarboxylic acids Carboxylic acid salts Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Alkyl fluorides Organic cations
Molecular Framework
Not available
Substituents
Naphthylisoquinoline - Dihydroisoquinoline - Naphthalene - Methoxyaniline - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Carboxylic acid salt - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Alkyl halide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthylisoquinolines. These are polycyclic aromatic compounds containing a naphthalene moiety linked to an isoquinoline through a CC or CN single bond.
External Descriptors
Not available