Structure Information
Structure

Compound Identification

SMILES

COC1=NC=C(NC(C#N)=C2C(=O)C3=CC=CC=C3C2=O)C=C1

InChIKey

InChIKey=MMISPKZKVHPRKC-UHFFFAOYSA-N

Formula

C17H11N3O3

Mass

305.293

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Indanes

Subclass

Indanones

Intermediate Tree Nodes

Not available

Direct Parent

Indanediones

Alternative Parents

Aryl ketones Aminopyridines and derivatives Alkyl aryl ethers Vinylogous amides Heteroaromatic compounds Nitriles Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indanedione - Aryl ketone - Alkyl aryl ether - Aminopyridine - Pyridine - Heteroaromatic compound - Vinylogous amide - Ketone - Enamine - Ether - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Cyanide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indanediones. These are compounds containing an indane ring bearing two ketone groups.

External Descriptors

Not available

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