Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(C=C1)C(=O)C1=C(N)N=C(NC2=CC=C(C=C2)N2CCC(CC2)N2CCOCC2)S1)[N+]([O-])=O

InChIKey

InChIKey=LYPXPGRSHDVDNY-UHFFFAOYSA-N

Formula

C26H30N6O5S

Mass

538.62

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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

Aryl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl-phenylketone - Phenylpiperidine - Nitrophenyl ether - Methoxyaniline - Nitrobenzene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Anisole - Benzoyl - Nitroaromatic compound - Phenol ether - Methoxybenzene - Phenoxy compound - 2,4,5-trisubstituted 1,3-thiazole - Aniline or substituted anilines - 4-aminopiperidine - Alkyl aryl ether - 1,3-thiazolamine - Monocyclic benzene moiety - Morpholine - Oxazinane - 1,3-thiazol-2-amine - Piperidine - Benzenoid - Imidolactam - Azole - Thiazole - Heteroaromatic compound - Vinylogous amide - C-nitro compound - Organic nitro compound - Tertiary aliphatic amine - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Oxacycle - Dialkyl ether - Ether - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Primary amine - Organic oxide - Organic zwitterion - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.

External Descriptors

Not available

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