Compound Identification
SMILES
[O-]C1=C(C=CC(=C1)C(=O)OCC(=O)C1=CC=C(Br)C=C1)[N+]([O-])=O
InChIKey
InChIKey=NIFIIRYSZZNQTD-UHFFFAOYSA-M
Formula
C15H9BrNO6
Mass
379.143
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
Nitrobenzoic acids and derivatives Benzoic acid esters Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Phenoxides Bromobenzenes Aryl bromides Carboxylic acid esters Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organobromides Organonitrogen compounds Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Nitrobenzoate - Benzoate ester - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Bromobenzene - Halobenzene - Phenoxide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Organic oxoazanium - Carboxylic acid derivative - Organonitrogen compound - Organobromide - Organic salt - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organic cation - Aromatic homomonocyclic 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