Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(NC=C2C(=O)N(C(=O)C3=CC=CC=C23)C2=CC=CC(=C2)C(F)(F)F)=C1
InChIKey
InChIKey=BNDHDLRHYRQHPJ-UHFFFAOYSA-N
Formula
C23H14F3N3O4
Mass
453.377
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1,3-isoquinolinediones
Intermediate Tree Nodes
Not available
Direct Parent
1,3-isoquinolinediones
Alternative Parents
Isoquinolones and derivatives Trifluoromethylbenzenes Tetrahydroisoquinolines Nitrobenzenes Aniline and substituted anilines Nitroaromatic compounds Secondary alkylarylamines N-substituted carboxylic acid imides Vinylogous amides Dicarboximides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Enamines Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Organofluorides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Trifluoromethylbenzene - Tetrahydroisoquinoline - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Carboxylic acid imide - Dicarboximide - Vinylogous amide - Organic nitro compound - Amino acid or derivatives - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Carboxylic acid derivative - Enamine - Organic oxoazanium - Azacycle - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Alkyl fluoride - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Amine - Alkyl halide - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.
External Descriptors
Not available