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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Halophenols
-
Level 5
Fluorophenols
- Level 6 O-fluorophenols
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Level 5
Fluorophenols
-
Subclass
Halophenols
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Halophenols
Intermediate Tree Nodes
Fluorophenols
Direct Parent
O-fluorophenols
Alternative Parents
Pyridinones 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 2-halopyridines Dihydropyridines Fluorobenzenes Aryl fluorides Imidolactams Heteroaromatic compounds Imidazolines Lactams Carboximidamides Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Amines Alkyl fluorides Organofluorides Organooxygen compounds
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