Compound Identification
SMILES
NC1=NC=NC2=C1C(COCC1=CC=CC=C1[N+]([O-])=O)=CN2[C@H]1C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O1
InChIKey
InChIKey=TXABEKJPUFVIFW-ARFHVFGLSA-N
Formula
C19H24N5O15P3
Mass
655.342
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 Nitroaromatic compounds Aminopyrimidines and derivatives Monoalkyl phosphates Substituted pyrroles Imidolactams Oxolanes Heteroaromatic compounds Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzylether - Pyrrolo[2,3-d]pyrimidine - Nitrobenzene - Pyrrolopyrimidine - Nitroaromatic compound - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Substituted pyrrole - Alkyl phosphate - Imidolactam - Oxolane - Pyrrole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Secondary alcohol - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Dialkyl ether - Ether - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Alcohol - Organooxygen compound - Organic oxide - Amine - Primary amine - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen 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