Structure Information
Structure

Compound Identification

SMILES

OC(C(C#N)C#N)C1=CNC2=CC=CC=C12

InChIKey

InChIKey=IWLHRBWNHKDGRS-UHFFFAOYSA-N

Formula

C12H9N3O

Mass

211.224

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

3-alkylindoles

Alternative Parents

Substituted pyrroles Benzenoids Heteroaromatic compounds Secondary alcohols Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Aromatic alcohols

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-alkylindole - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Secondary alcohol - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.

External Descriptors

Not available

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