Compound Identification
SMILES
CC(=O)C1=CC(NC(=O)C(=O)C(C2=CN=C3C=CC(=CC3=N2)[N+]([O-])=O)[N+]([O-])=O)=CC=C1
InChIKey
InChIKey=POBPSTWMYMQFOL-UHFFFAOYSA-N
Formula
C19H13N5O7
Mass
423.341
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
Quinoxalines Acetophenones Anilides Aryl alkyl ketones Benzoyl derivatives N-arylamides Nitroaromatic compounds Fatty amides Pyrazines Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Diazanaphthalene - Quinoxaline - Acetophenone - Anilide - Nitroaromatic compound - N-arylamide - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - Pyrazine - Fatty acyl - Fatty amide - Heteroaromatic compound - C-nitro compound - Carboxamide group - Secondary carboxylic acid amide - Organic nitro compound - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - 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