Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)CCC(=O)C2=CC=C(C)C=C2)=C(C)N1C1=CC=C(Br)C=C1
InChIKey
InChIKey=KMLWBGKWKYITCP-UHFFFAOYSA-N
Formula
C25H24BrNO4
Mass
482.374
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
Butyrophenones Phenylpyrroles Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives Fatty acid esters Bromobenzenes Alpha-acyloxy ketones Toluenes Aryl bromides Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - 1-phenylpyrrole - Gamma-keto acid - Aryl alkyl ketone - Benzoyl - Bromobenzene - Alpha-acyloxy ketone - Halobenzene - Toluene - Fatty acid ester - Fatty acyl - Benzenoid - Substituted pyrrole - Aryl halide - Aryl bromide - Keto acid - Monocyclic benzene moiety - Vinylogous amide - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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