Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)N1C(=O)[C@H]2[C@H]3C=C(C=CN3[C@H]([C@@H]2C1=O)C(=O)C1=CC(=CC=C1)[N+]([O-])=O)C#N

InChIKey

InChIKey=LRYGJZHKKUCEHX-CIAFKFPVSA-N

Formula

C25H18N4O5

Mass

454.442

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - 1-phenylpyrrolidine - Nitrobenzene - Nitroaromatic compound - Aryl alkyl ketone - Benzoyl - Toluene - Dihydropyridine - 2-pyrrolidone - Benzenoid - Pyrrolidone - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrole - Alpha-aminoketone - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Amino acid or derivatives - Lactam - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Allylamine - Azacycle - Enamine - Carbonitrile - Nitrile - Organic oxoazanium - Organoheterocyclic compound - Amine - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organic zwitterion - Organic oxide - Organonitrogen compound - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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