Structure Information
Structure

Compound Identification

SMILES

CC(OC(=O)C1CN(NC(=O)C2=CC=C(C=C2)[N+]([O-])=O)C(=O)C1)C(=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=ILCFQSMMBHZJHV-UHFFFAOYSA-N

Formula

C21H18ClN3O7

Mass

459.84

Export to:

JSON SDF CSV

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 - Benzoic acid or derivatives - Nitrobenzene - Phenylpropane - Benzoyl - Nitroaromatic compound - Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aryl alkyl ketone - Alpha-acyloxy ketone - Chlorobenzene - Halobenzene - Aryl chloride - Benzenoid - Aryl halide - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Pyrrolidine - Organic nitro compound - Carboxylic acid ester - Carboxylic acid hydrazide - Lactam - C-nitro compound - Organic oxoazanium - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Organic zwitterion - Organic oxide - 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

Previous Back Next