Compound Identification
SMILES
CCOC(=O)C1C(NC(C(C(=O)C2=CC=C(Cl)C=C2)S1(=O)=O)C1=CC=CC2=CC=CC=C12)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=MPNIPJVWIHMFKC-UHFFFAOYSA-N
Formula
C34H28ClNO5S
Mass
598.11
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
Naphthalenes Thiomorpholine carboxylic acids and derivatives Aryl alkyl ketones Benzoyl derivatives Aralkylamines Chlorobenzenes Beta-amino ketones Aryl chlorides Sulfones Amino acids and derivatives Carboxylic acid esters Dialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Naphthalene - Thiomorpholine-2-carboxylic acid - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Beta-aminoketone - 1,4-thiazinane - Benzenoid - Sulfone - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Azacycle - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Organohalogen compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organonitrogen 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