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Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)C1=CSC(=N1)N1CC(CC1=O)C(=O)OCC(=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=LTLIJUBYPFCADJ-UHFFFAOYSA-N

Formula

C23H19N3O6S

Mass

465.48

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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 - Nitrobenzene - Nitroaromatic compound - Pyrrolidine carboxylic acid or derivatives - Aryl alkyl ketone - Benzoyl - Oxoproline - Pyrrolidine carboxylic acid - 2,4-disubstituted 1,3-thiazole - Toluene - Alpha-acyloxy ketone - 2-pyrrolidone - Benzenoid - Pyrrolidone - Monocyclic benzene moiety - Thiazole - Azole - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Lactam - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Organic oxoazanium - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic salt - Organic zwitterion - 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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