Compound Identification
SMILES
COC(=O)OC1=C(C)NC(=NC1C1=C(Cl)C=C(F)C=C1)C1=C(F)C=C(F)C=N1
InChIKey
InChIKey=BBEFOBSVWMOBTO-UHFFFAOYSA-N
Formula
C18H13ClF3N3O3
Mass
411.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Halopyridines
- Level 5 Polyhalopyridines
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Subclass
Halopyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Halopyridines
Intermediate Tree Nodes
Not available
Direct Parent
Polyhalopyridines
Alternative Parents
Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Carbonic acid diesters Imidolactams Hydropyrimidines Enol esters Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Enamines Carboximidamides Carboxamidines Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Polyhalopyridine - Fluorobenzene - Halobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Imidolactam - Hydropyrimidine - Benzenoid - Monocyclic benzene moiety - Carbonic acid diester - Enol ester - Heteroaromatic compound - Carbonic acid derivative - Carboxylic acid amidine - Enamine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Amidine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by a halogen atom.
External Descriptors
Not available