Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C(=O)CN1CC2CN(CCCNC3=CC=C(C=C3)C#N)CC(C1)O2

InChIKey

InChIKey=KZOCHEDMAHPYCK-UHFFFAOYSA-N

Formula

C22H32N4O2

Mass

384.524

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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 - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Morpholine - Oxazinane - Alpha-aminoketone - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Oxacycle - Secondary amine - Organoheterocyclic compound - Dialkyl ether - Ether - Carbonitrile - Nitrile - Amine - Organonitrogen compound - Cyanide - Organic nitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen 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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