Compound Identification
SMILES
O=C(CC1=NNC2=NC3=CC=CC=C3N2C1=O)C1=CC=CC=C1
InChIKey
InChIKey=LTGAYBFQFABJDX-UHFFFAOYSA-N
Formula
C17H12N4O2
Mass
304.309
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
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 - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Imidazo[2,1-c][1,2,4]triazines Benzimidazoles Benzoyl derivatives Aryl alkyl ketones N-substituted imidazoles 1,2,4-triazines Heteroaromatic compounds Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Imidazo[2,1-c][1,2,4]triazine - Benzimidazole - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - N-substituted imidazole - Triazine - 1,2,4-triazine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available