Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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