Compound Identification
SMILES
BrC1=CC=CC(=C1)C1CC(=O)N(CN2CCN(CC2)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=ONDJVHWCAVIVRB-UHFFFAOYSA-N
Formula
C21H22BrN3O2
Mass
428.33
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 Phenylpyrrolidines Aniline and substituted anilines Dialkylarylamines Bromobenzenes N-alkylpiperazines Pyrrolidine-2-ones Aryl bromides N-alkylpyrrolidines N-substituted carboxylic acid imides Dicarboximides Pyrroles Lactams Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organobromides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - 3-phenylpyrrolidine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Bromobenzene - N-alkylpiperazine - Carboxylic acid imide, n-substituted - Aryl halide - 2-pyrrolidone - Pyrrolidone - Aryl bromide - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Pyrrolidine - Pyrrole - Carboxylic acid imide - Dicarboximide - Amino acid or derivatives - Tertiary amine - Lactam - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - 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