Structure Information
Structure

Compound Identification

SMILES

CC1(C)OC[C@@H](O1)[C@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@@H]1\[N+]([O-])=C\C1=CC=C(C=C1)C#N

InChIKey

InChIKey=DCRXWDRNWSCHKY-OLUDVYBYSA-N

Formula

C20H24N2O6

Mass

388.42

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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 heteropolycyclic compounds

Substituents

Benzonitrile - Ketal - Meta-dioxolane - Oxolane - Nitrone - Shiff base - Acetal - Carbonitrile - Nitrile - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Organic oxide - Cyanide - Organooxygen compound - Organic zwitterion - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organopnictogen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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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