Structure Information
Structure

Compound Identification

SMILES

CC1(C)C(=O)NC(=O)C2=C1C=CC1=C2N=C(NC2=C(Br)C=C(Br)C=C2Br)N1

InChIKey

InChIKey=KYQOAPIJIRYMIR-UHFFFAOYSA-N

Formula

C18H13Br3N4O2

Mass

557.04

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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 - Tetrahydroisoquinoline - Benzimidazole - Aniline or substituted anilines - Bromobenzene - Halobenzene - Aminoimidazole - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-unsubstituted - Heteroaromatic compound - Imidazole - Dicarboximide - Carboxylic acid imide - Azole - Amino acid or derivatives - Azacycle - Secondary amine - Carboxylic acid derivative - Organobromide - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organohalogen compound - 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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