Structure Information
Structure

Compound Identification

SMILES

[Ac].CCOC(C)OCC1CC(N(C)C1C([NH-])C(=O)CC)C(C)=O

InChIKey

InChIKey=PHAHPXXCKVFURU-UHFFFAOYSA-N

Formula

C16H29AcN2O4

Mass

540.419

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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

Direct Parent

Beta-amino ketones

Alternative Parents

N-alkylpyrrolidines Alpha-amino ketones Trialkylamines Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes Organic anions

Molecular Framework

Not available

Substituents

Beta-aminoketone - N-alkylpyrrolidine - Alpha-aminoketone - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Acetal - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Amine - Organic nitrogen compound - Aldehyde - Organic anion - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta-amino ketones. These are ketones containing a carboxylic acid, and an amine group attached to the beta carbon atom, relative to the C=O group.

External Descriptors

Not available

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