Compound Identification
SMILES
CC1=C(C)C=C(C=C1)N1CCN(CC1)C1=C(C(=NC=N1)N1CCN(CC2=CC3=C(OCO3)C=C2)CC1)[N+]([O-])=O
InChIKey
InChIKey=WPUHDNSRWHNYGV-UHFFFAOYSA-N
Formula
C28H33N7O4
Mass
531.617
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 Benzodioxoles Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds o-Xylenes Aminopyrimidines and derivatives Aralkylamines N-alkylpiperazines Imidolactams Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Acetals Organic oxoazanium compounds Organic salts Organopnictogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Phenylpiperazine - Benzodioxole - Dialkylarylamine - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Nitroaromatic compound - Xylene - O-xylene - N-alkylpiperazine - Aminopyrimidine - Aralkylamine - Pyrimidine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Heteroaromatic compound - Organic nitro compound - Tertiary aliphatic amine - Tertiary amine - C-nitro compound - Acetal - Organic oxoazanium - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organic cation - 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