Structure Information
Structure

Compound Identification

SMILES

CC1=CC[C@]2(C#N)C3(OCCO3)N=C(N)[C@]2(C1)C#N

InChIKey

InChIKey=VOVRHYJXRBXJDF-NWDGAFQWSA-N

Formula

C13H14N4O2

Mass

258.281

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoindoles and derivatives

Subclass

Isoindoles

Intermediate Tree Nodes

Not available

Direct Parent

Isoindoles

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Isoindole - Imidolactam - Meta-dioxolane - Pyrroline - Orthocarboxylic acid derivative - Amidine - Carboxylic acid amidine - Carbonitrile - Nitrile - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole.

External Descriptors

Not available

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