Compound Identification
SMILES
OCC1=CC=C(C=C1)C1CC(CN2CCN(CC2)C2=CC=C(C=C2)[N+]([O-])=O)OC(O1)C1=CC=CC(=C1)C1=CC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)=CC=C1
InChIKey
InChIKey=QNFWOJPBYHLKOI-UHFFFAOYSA-N
Formula
C46H53N5O6
Mass
771.959
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
Biphenyls and derivatives N-arylpiperazines Nitrobenzenes Aniline and substituted anilines Benzyl alcohols Dialkylarylamines Nitroaromatic compounds N-alkylpiperazines Aralkylamines 1,3-dioxanes Trialkylamines Ureas Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Acetals Azacyclic compounds Oxacyclic compounds Organic salts Hydrocarbon derivatives Primary alcohols Carbonyl compounds Aromatic alcohols Organic zwitterions Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenyl - Phenylpiperazine - N-arylpiperazine - Nitrobenzene - Benzyl alcohol - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - N-alkylpiperazine - Aralkylamine - Meta-dioxane - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Urea - C-nitro compound - Organic nitro compound - Oxacycle - Acetal - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Alcohol - Aromatic alcohol - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organic zwitterion - Organic salt - Amine - Hydrocarbon derivative - 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