Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

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

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