Compound Identification
SMILES
COC1=C(OC2=NC=NC(N3CCN(CC3)C3=CC=CC=N3)=C2[N+]([O-])=O)C=CC(=C1)C(=O)NN
InChIKey
InChIKey=SESCNPIJIRVKQR-UHFFFAOYSA-N
Formula
C21H22N8O5
Mass
466.458
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 Pyridinylpiperazines
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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
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines Diarylethers Benzoic acids and derivatives Benzoyl derivatives Dialkylarylamines Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Aminopyrimidines and derivatives Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Diaryl ether - Benzoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Anisole - Benzoyl - Methoxybenzene - Dialkylarylamine - Phenol ether - Alkyl aryl ether - Aminopyridine - Aminopyrimidine - Monocyclic benzene moiety - Imidolactam - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxylic acid hydrazide - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Ether - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available