Structure Information
Structure

Compound Identification

SMILES

CCC(CC)[C@@H](CNC(=O)N[C@@H](C)C1=CC=C(C=C1)C#N)N1CCOCC1

InChIKey

InChIKey=IEZSCZZDGGSWJN-OXJNMPFZSA-N

Formula

C21H32N4O2

Mass

372.513

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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 - Morpholine - Oxazinane - Tertiary amine - Tertiary aliphatic amine - Urea - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen 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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