Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)ON\C(C1=C(O)C=CC(=C1)C#N)=C1\N=CC=CC1=O

InChIKey

InChIKey=CAKRMILCNUMEIG-FOCLMDBBSA-N

Formula

C17H17N3O3

Mass

311.341

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzonitrile - 1-hydroxy-2-unsubstituted benzenoid - Dihydropyridine - Phenol - Hydropyridine - Vinylogous amide - Ketone - Cyclic ketone - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - N-organohydroxylamine - Carbonitrile - Nitrile - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Imine - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

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