Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.FC1=C(C=CC(=C1)N1CCN(CC1)C1CC2CC(CC2C1)C1=CC=CC=C1)C#N
InChIKey
InChIKey=MABFNEIOVCLJIW-WLHGVMLRSA-N
Formula
C29H32FN3O4
Mass
505.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
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Subclass
Piperazines
- Level 5 Phenylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Aniline and substituted anilines Benzonitriles Dialkylarylamines Aralkylamines Fluorobenzenes N-alkylpiperazines Unsaturated fatty acids Dicarboxylic acids and derivatives Aryl fluorides Trialkylamines Carboxylic acids Azacyclic compounds Nitriles Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Phenylpiperazine - N-arylpiperazine - Benzonitrile - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - N-alkylpiperazine - Fluorobenzene - Halobenzene - Aryl halide - Fatty acyl - Fatty acid - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Cyanide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic 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