Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)CC1(O)C(=O)N(CN2CCOCC2)C2=C1C=C(Br)C=C2
InChIKey
InChIKey=HUGSYVHEPKRMQZ-UHFFFAOYSA-N
Formula
C22H23BrN2O5
Mass
475.339
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
Indoles and derivatives Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Aryl bromides Morpholines Beta-hydroxy ketones Tertiary carboxylic acid amides Tertiary alcohols Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Indole or derivatives - Phenoxy compound - Anisole - Phenol ether - Aryl alkyl ketone - Methoxybenzene - Benzoyl - Alkyl aryl ether - Morpholine - Aryl bromide - Beta-hydroxy ketone - Oxazinane - Monocyclic benzene moiety - Benzenoid - Aryl halide - Tertiary alcohol - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organobromide - Hydrocarbon derivative - Alcohol - 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