Compound Identification
SMILES
COC1=CC=CC(=C1)C1=C[N+](CC(=O)C2=CC(=CC=C2)[N+]([O-])=O)=C(N)N1C
InChIKey
InChIKey=NSEKGGNNJGFQGH-UHFFFAOYSA-O
Formula
C19H19N4O4
Mass
367.384
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
Phenylimidazoles Nitrobenzenes 1,2,4-trisubstituted imidazoles 1,2,5-trisubstituted imidazoles Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Aminoimidazoles N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Primary amines Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - 5-phenylimidazole - 4-phenylimidazole - Nitrobenzene - 1,2,4-trisubstituted-imidazole - 1,2,5-trisubstituted-imidazole - Anisole - Benzoyl - Phenol ether - Phenoxy compound - Nitroaromatic compound - Trisubstituted imidazole - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Aminoimidazole - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Ether - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organonitrogen compound - Amine - Primary amine - Organic cation - Aromatic heteromonocyclic 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