Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)[C@H]2[C@@H]3CCC[NH+]3[C@@H]([C@@H]2C1=O)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=NMGOVUSWQPVCMX-HAGHYFMRSA-O
Formula
C23H23N2O4
Mass
391.446
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
Beta amino acids and derivatives Phenylpyrrolidines Methoxyanilines Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds Pyrrolizidines Alkyl aryl ethers N-substituted carboxylic acid imides N-alkylpyrrolidines Pyrrolidine-2-ones Alpha-amino ketones Quaternary ammonium salts Dicarboximides Pyrroles Lactams Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 1-phenylpyrrolidine - Beta amino acid or derivatives - Methoxyaniline - Pyrrolizidine - Phenol ether - Aryl alkyl ketone - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Alkyl aryl ether - Benzenoid - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Alpha-aminoketone - Carboxylic acid imide - Dicarboximide - Pyrrole - Pyrrolidine - Quaternary ammonium salt - Lactam - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - 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