Compound Identification
SMILES
[O-][N+](=O)C1=CC(Br)=C(C=C1)N1C(=O)C2=C(C=C(C=C2)C(=O)OCC(=O)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=FCDAZZNDAGQDMQ-UHFFFAOYSA-N
Formula
C23H13BrN2O7
Mass
509.268
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
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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
Phthalimides Isoindoles Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Bromobenzenes N-substituted carboxylic acid imides Aryl bromides Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organic salts Organic zwitterions Organobromides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phthalimide - Isoindolone - Nitrobenzene - Isoindole or derivatives - Isoindole - Isoindoline - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Halobenzene - Bromobenzene - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Carboxylic acid imide - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organic zwitterion - Organonitrogen compound - Organobromide - Organic oxide - Organohalogen 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