Structure Information
Structure

Compound Identification

SMILES

CC[NH+]1CCN(CC1)C=C1C(=O)N(C(=O)C2=CC=CC=C12)C1=C(C)C=CC=C1CC

InChIKey

InChIKey=VQGKRDQFSHMSEW-UHFFFAOYSA-O

Formula

C25H30N3O2

Mass

404.533

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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 - N-alkylpiperazine - Toluene - Monocyclic benzene moiety - 1,4-diazinane - Carboxylic acid imide, n-substituted - Piperazine - Benzenoid - Carboxylic acid imide - Dicarboximide - Vinylogous amide - Quaternary ammonium salt - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Azacycle - Enamine - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic cation - 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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