Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(Br)N(N=C1)C1=C(C=C(C=C1)C(F)(F)F)[N+]([O-])=O

InChIKey

InChIKey=CFRQJQQYBFNEMH-UHFFFAOYSA-N

Formula

C13H9BrF3N3O4

Mass

408.131

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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 - Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - Pyrazole-4-carboxylic acid or derivatives - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous halide - Vinylogous amide - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Alkyl halide - Organic salt - Organofluoride - Organobromide - Organonitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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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