Compound Identification
SMILES
CC1=CC=C(C=C1)N1C(=O)[C@H]2[C@H]3C=C(C=CN3[C@H]([C@@H]2C1=O)C(=O)C1=CC(=CC=C1)[N+]([O-])=O)C#N
InChIKey
InChIKey=LRYGJZHKKUCEHX-CIAFKFPVSA-N
Formula
C25H18N4O5
Mass
454.442
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
Phenylpyrrolidines Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Toluenes Dihydropyridines Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Alpha-amino ketones Dicarboximides Trialkylamines Amino acids and derivatives Lactams Allylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Enamines Nitriles Organic oxides Organic zwitterions Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 1-phenylpyrrolidine - Nitrobenzene - Nitroaromatic compound - Aryl alkyl ketone - Benzoyl - Toluene - Dihydropyridine - 2-pyrrolidone - Benzenoid - Pyrrolidone - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrole - Alpha-aminoketone - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Amino acid or derivatives - Lactam - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Allylamine - Azacycle - Enamine - Carbonitrile - Nitrile - Organic oxoazanium - Organoheterocyclic compound - Amine - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organic zwitterion - Organic oxide - Organonitrogen compound - Organic salt - 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