Compound Identification
SMILES
ClC1=C(C2=CC=C(Br)C=C2)C(=O)C2=C(NC(=N2)C2=CC=CC=N2)C1=O
InChIKey
InChIKey=RWUXCFYCQXIYBF-UHFFFAOYSA-N
Formula
C18H9BrClN3O2
Mass
414.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
- Level 6 Aryl ketones
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Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones
Direct Parent
Aryl ketones
Alternative Parents
Bromobenzenes Pyridines and derivatives Aryl bromides Vinylogous halides Vinylogous amides Alpha-chloroketones Heteroaromatic compounds Imidazoles Vinyl chlorides Azacyclic compounds Chloroalkenes Organonitrogen compounds Organochlorides Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl ketone - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Alpha-haloketone - Alpha-chloroketone - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Vinylogous halide - Azacycle - Chloroalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.
External Descriptors
Not available