Compound Identification
SMILES
CCOC1=CC=C(C=C1)C(=O)C1C(C[NH+](C)C11C(=O)N(CC2=CC(Cl)=CC=C2)C2=CC=CC=C12)C1=CC=CO1
InChIKey
InChIKey=HKMJGNJJAWSOOT-UHFFFAOYSA-O
Formula
C32H30ClN2O4
Mass
542.05
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
Alpha amino acids and derivatives Indoles and derivatives Aryl alkyl ketones Benzoyl derivatives Phenol ethers Phenoxy compounds Alkyl aryl ethers Aralkylamines Chlorobenzenes N-alkylpyrrolidines Beta-amino ketones Aryl chlorides Gamma-amino ketones Tertiary carboxylic acid amides Furans Heteroaromatic compounds Quaternary ammonium salts Trialkylamines Lactams Oxacyclic compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid or derivatives - Indole or derivatives - Phenoxy compound - Phenol ether - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aralkylamine - Aryl chloride - Gamma-aminoketone - Aryl halide - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Beta-aminoketone - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrolidine - Quaternary ammonium salt - Furan - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Lactam - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - 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