Compound Identification
SMILES
CC(C)[C@H](OCC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)C2=C1C(N)=NC=N2)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=WOGXWRHVWDQXKR-XFKSJGNHSA-N
Formula
C22H30N5O15P3
Mass
697.423
Taxonomic Classification
Taxonomy Tree
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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
Pyrrolo[2,3-d]pyrimidines Benzylethers Phenylpropanes Nitroaromatic compounds Aminopyrimidines and derivatives Monoalkyl phosphates Substituted pyrroles Imidolactams Oxolanes Heteroaromatic compounds Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkyl ethers Oxacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic zwitterions Organic salts Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - Phenylpropane - Nitrobenzene - Pyrrolo[2,3-d]pyrimidine - Benzylether - Nitroaromatic compound - Monoalkyl phosphate - Aminopyrimidine - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Pyrimidine - Imidolactam - Substituted pyrrole - Heteroaromatic compound - Oxolane - Pyrrole - C-nitro compound - Organic nitro compound - Secondary alcohol - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Dialkyl ether - Ether - Azacycle - Oxacycle - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Amine - Primary amine - Organic oxygen compound - Organic salt - Organic nitrogen compound - 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