Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=CC=C1)N1C(=O)C(=CC2=CC=C(O2)C2=CC(=CC=C2)[N+]([O-])=O)C2=CC=CC=C2C1=O

InChIKey

InChIKey=UNNBBAHTMTZGOV-UHFFFAOYSA-N

Formula

C27H18N2O5

Mass

450.45

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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 - Nitrobenzene - Nitroaromatic compound - Toluene - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Furan - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Organic oxygen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen 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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