Structure Information
Structure

Compound Identification

SMILES

CCCC(NOC\C=C\Cl)=C1C(=O)CC(CC(C)SCC)C(C(=O)OCC)C1=O

InChIKey

InChIKey=ZAGYFJFRIYWILR-LQZQTDKRSA-N

Formula

C21H32ClNO5S

Mass

446.0

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

1,3-dicarbonyl compounds

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

1,3-dicarbonyl compound - Vinylogous amide - Carboxylic acid ester - Ketone - Cyclic ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Vinyl chloride - Vinyl halide - Sulfenyl compound - N-organohydroxylamine - Dialkylthioether - Haloalkene - Chloroalkene - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 1,3-dicarbonyl compounds. These are carbonyl compounds with the generic formula O=C(R)C(H)C(R')=O, where R and R' can be any group.

External Descriptors

Not available

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