Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(OCC2CN(CC3=CC=C(C=C3)N(CCC#N)CCC#N)CCO2)=C(C=C1)C(C)=O

InChIKey

InChIKey=KZTZMRCGXGETNA-UHFFFAOYSA-N

Formula

C28H34N4O5

Mass

506.603

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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 - Dimethoxybenzene - O-dimethoxybenzene - Acetophenone - Phenylmethylamine - Tertiary aliphatic/aromatic amine - Phenol ether - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Anisole - Benzoyl - Benzylamine - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Aralkylamine - Benzenoid - Oxazinane - Monocyclic benzene moiety - Morpholine - Tertiary aliphatic amine - Tertiary amine - Nitrile - Carbonitrile - Organoheterocyclic compound - Ether - Dialkyl ether - Azacycle - Oxacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Cyanide - 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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