Structure Information
Structure

Compound Identification

SMILES

CC1=NOC(=O)[C@@]11[C@H](C2=CC=CC=C2)C(C#N)(C#N)C(C#N)=C1N

InChIKey

InChIKey=PCKACTMTICUFCB-CXAGYDPISA-N

Formula

C17H11N5O2

Mass

317.308

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azolines

Subclass

Isoxazolines

Intermediate Tree Nodes

Not available

Direct Parent

Isoxazolinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Monocyclic benzene moiety - Isoxazolinone - Benzenoid - Oximester - Amino acid or derivatives - Carboxylic acid salt - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Oxacycle - Azacycle - Carbonyl group - Organic oxygen compound - Primary aliphatic amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic salt - Amine - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoxazolinones. These are compounds containing an isoxazoline ring that bears a ketone group.

External Descriptors

Not available

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