Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(C#N)C1(CCOC(C)(CC)C1)C1=CC=C(C)C=C1

InChIKey

InChIKey=LQFZXZWNYQBDOY-UHFFFAOYSA-N

Formula

C20H27NO3

Mass

329.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Not available

Direct Parent

Toluenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Fatty acid ester - Toluene - Oxane - Fatty acyl - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Oxacycle - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Cyanide - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.

External Descriptors

Not available

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