Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(COC(=O)CCC(=O)C2=CC=CC=C2)C(C(=O)OC)=C(N)S1

InChIKey

InChIKey=MFYOBJPRTGQMFB-UHFFFAOYSA-N

Formula

C19H19NO7S

Mass

405.42

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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 - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Gamma-keto acid - Thiophene carboxylic acid or derivatives - Aryl alkyl ketone - Fatty acid ester - Monocyclic benzene moiety - Keto acid - 2-aminothiophene - Benzenoid - Fatty acyl - Thiophene - Heteroaromatic compound - Methyl ester - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - 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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