Compound Identification
SMILES
CC(=O)C1=C(OCC2CN(CCO2)C(=O)C2=C(C)OC(=C2)C2=CC=CC=C2)C=CC(Cl)=C1
InChIKey
InChIKey=OEJHKQZLTHXXFK-UHFFFAOYSA-N
Formula
C25H24ClNO5
Mass
453.92
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
Acetophenones Morpholine carboxylic acids and derivatives Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Furan-3-carboxylic acid and derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxides Organonitrogen compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Morpholine-4-carboxylic acid or derivatives - Furoic acid or derivatives - Phenol ether - Aryl alkyl ketone - Benzoyl - Furan-3-carboxylic acid or derivatives - Phenoxy compound - Halobenzene - Chlorobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Benzenoid - Oxazinane - Aryl halide - Aryl chloride - Furan - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organic nitrogen compound - Organic oxide - Organohalogen 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