Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@@]1(C#N)[C@H]([C@@H]2CCCC=C2C(C#N)=C1N)C1=CC=CC=C1

InChIKey

InChIKey=OLUGSZUWEAVXBJ-MMOPVJDHSA-N

Formula

C21H21N3O2

Mass

347.418

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzene and substituted derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Monocyclic benzene moiety - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Carbonyl group - Organic oxygen compound - Primary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.

External Descriptors

Not available

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