Compound Identification
SMILES
CN1C(=NC2=C(C(C)=NN2CCC#N)P1(=NC1=CC=C(C=C1)[N+]([O-])=O)N1CCOCC1)C1=CC=CC=C1
InChIKey
InChIKey=BRPSASJDRRJJMY-UHFFFAOYSA-N
Formula
C25H27N8O3P
Mass
518.518
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
Nitroaromatic compounds Morpholines Imidolactams Pyrazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Phosphacyclic compounds Oxacyclic compounds Amidines Azacyclic compounds Organic oxoazanium compounds Dialkyl ethers Nitriles Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Morpholine - Oxazinane - Imidolactam - Azole - Pyrazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Amidine - Dialkyl ether - Ether - Carbonitrile - Nitrile - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Phosphacycle - Organoheterocyclic compound - Azacycle - Oxacycle - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic salt - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic cation - 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