Compound Identification
SMILES
OC(CN1C=NC=N1)(C(=O)C1=C(Cl)C=C(Cl)C=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=IJYGNBNBMXUQHJ-UHFFFAOYSA-N
Formula
C17H12Cl2FN3O2
Mass
380.2
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Stilbenes
Subclass
Benzoins
Intermediate Tree Nodes
Not available
Direct Parent
Benzoins
Alternative Parents
Alkyl-phenylketones Aryl alkyl ketones Benzoyl derivatives Dichlorobenzenes Fluorobenzenes Acyloins Aryl chlorides Aryl fluorides Heteroaromatic compounds Tertiary alcohols Alpha-hydroxy ketones Vinylogous halides Triazoles Azacyclic compounds Organofluorides Organonitrogen compounds Aromatic alcohols Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoin - Alkyl-phenylketone - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - 1,3-dichlorobenzene - Chlorobenzene - Fluorobenzene - Halobenzene - Acyloin - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha-hydroxy ketone - Azole - Heteroaromatic compound - Vinylogous halide - 1,2,4-triazole - Tertiary alcohol - Ketone - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Aromatic alcohol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoins. These are organic compounds containing a 1,2-hydroxy ketone attached to two phenyl groups.
External Descriptors
Not available