Compound Identification
SMILES
CC1=C(N[P@@]2(=O)N(NC3=CC(C)(C)CC(N4CCCCC4)=C23)C2=CC=CC=C2)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=JBHORHIPZUXWJA-PGUFJCEWSA-N
Formula
C26H32N5O3P
Mass
493.548
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Nitrotoluenes Nitroaromatic compounds Piperidines Organic phosphonic acids and derivatives Diazaphospholanes Trialkylamines Propargyl-type 1,3-dipolar organic compounds Phosphacyclic compounds Organic oxoazanium compounds Enamines Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Toluene - Piperidine - Diazaphospholane - Organophosphonic acid derivative - C-nitro compound - Tertiary amine - Organic nitro compound - Tertiary aliphatic amine - Enamine - Organic oxoazanium - Phosphacycle - Azacycle - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organic salt - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available