Structure Information
Structure

Compound Identification

SMILES

CS(=O)(=O)C1=CC=C(C=C1)C1=CC(=NN1C1CCCCC1)C(=O)CCCO[N+]([O-])=O

InChIKey

InChIKey=UQXOOTPLRYWOQG-UHFFFAOYSA-N

Formula

C20H25N3O6S

Mass

435.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpyrazole - Benzenesulfonyl group - Aryl alkyl ketone - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Organic nitrate - Heteroaromatic compound - Alkyl nitrate - Sulfone - Sulfonyl - Ketone - Organic nitric acid or derivatives - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.

External Descriptors

Not available

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