Compound Identification
SMILES
CC(=O)N1CCC(CCC(=O)C2=CC3=C(NCCC3)C=C2)CC1
InChIKey
InChIKey=BOGQSXVBWRDZKA-UHFFFAOYSA-N
Formula
C19H26N2O2
Mass
314.429
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Hydroquinolines N-acylpiperidines Aryl alkyl ketones Secondary alkylarylamines Aralkylamines Tertiary carboxylic acid amides Acetamides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Tetrahydroquinoline - N-acyl-piperidine - Aryl ketone - Aryl alkyl ketone - Secondary aliphatic/aromatic amine - Aralkylamine - Piperidine - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Organoheterocyclic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available