Structure Information
Structure

Compound Identification

SMILES

COC1=C2CCC(=O)C(=CC2=C(OC)C=C1)C#N

InChIKey

InChIKey=OBNJAJVOVZWXHI-UHFFFAOYSA-N

Formula

C14H13NO3

Mass

243.262

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Alkyl aryl ethers Cyclic ketones Nitriles Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Anisole - Alkyl aryl ether - Ketone - Cyclic ketone - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Carbonyl group - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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