Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1C)C(=O)N1CCN(CC1)C1=C(C=C(C=C1)C(F)(F)F)[N+]([O-])=O

InChIKey

InChIKey=XSQNMZANKWCNKP-UHFFFAOYSA-N

Formula

C21H22F3N3O5

Mass

453.418

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpiperazines

Alternative Parents

N-arylpiperazines N,N-dialkyl-p-toluamides Trifluoromethylbenzenes Dimethoxybenzenes Benzamides Nitrobenzenes Aniline and substituted anilines Anisoles Benzoyl derivatives Dialkylarylamines Phenoxy compounds Nitroaromatic compounds Alkyl aryl ethers Tertiary carboxylic acid amides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organofluorides Organic salts Alkyl fluorides Organic oxides Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-arylpiperazine - Phenylpiperazine - N,n-dialkyl-p-toluamide - Dimethoxybenzene - M-dimethoxybenzene - Trifluoromethylbenzene - Benzamide - Nitrobenzene - Toluamide - P-toluamide - Benzoic acid or derivatives - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Nitroaromatic compound - Alkyl aryl ether - Toluene - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - C-nitro compound - Organic nitro compound - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Ether - Alkyl fluoride - Organooxygen compound - Alkyl halide - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organic salt - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.

External Descriptors

Not available

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