Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1N=C(N[C@]1(C1=CN=C(F)C=C1)C1=CC(O)=C(F)C=C1)C1=CN(C(F)F)C(=O)C=C1

InChIKey

InChIKey=JHSSGTLZNDSUTH-MQJDWESPSA-N

Formula

C21H16F4N4O2

Mass

432.379

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Halophenols

Intermediate Tree Nodes

Fluorophenols

Direct Parent

O-fluorophenols

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-fluorophenol - Pyridinone - Halobenzene - Fluorobenzene - Dihydropyridine - 2-halopyridine - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Aryl fluoride - Pyridine - Monocyclic benzene moiety - Aryl halide - Hydropyridine - Imidolactam - Heteroaromatic compound - 2-imidazoline - Lactam - Amidine - Carboxylic acid amidine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Amine - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-fluorophenols. These are fluorophenols carrying a iodine at the C2 position of the benzene ring.

External Descriptors

Not available

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