Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(=O)CCC(=O)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)N1C=NC=N1

InChIKey

InChIKey=IOSOZQTUBNCDJY-SFHVURJKSA-N

Formula

C23H22FN5O5

Mass

467.457

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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 heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Phenyltriazole - Phenyl-1,2,4-triazole - Phenoxy compound - Anisole - Phenol ether - Benzoyl - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Fluorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Fatty acyl - N-acyl-amine - Aryl halide - Fatty amide - Aryl fluoride - Oxazolidinone - Heteroaromatic compound - Azole - Oxazolidine - Triazole - 1,2,4-triazole - Carbamic acid ester - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic 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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