Structure Information
Structure

Compound Identification

SMILES

COC1=C(Cl)C=C(C=C1)C(=O)COC(=O)C1=CC2=C(S1)C=CC(=C2)[N+]([O-])=O

InChIKey

InChIKey=BUQIYOWIOZQUOZ-UHFFFAOYSA-N

Formula

C18H12ClNO6S

Mass

405.81

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Benzothiophene - 1-benzothiophene - Anisole - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Thiophene carboxylic acid or derivatives - Methoxybenzene - 2,3,5-trisubstituted thiophene - Aryl alkyl ketone - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organic zwitterion - Aromatic heteropolycyclic 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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