Compound Identification
SMILES
NC1=C(Cl)C=C(C(=O)CCC2CCN(CCCC3=CC=C(F)C=C3)CC2)C2=C1OCCO2
InChIKey
InChIKey=ITBCWWKGCXKGAW-UHFFFAOYSA-N
Formula
C25H30ClFN2O3
Mass
460.97
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
Phenylpropylamines Benzo-1,4-dioxanes Aryl alkyl ketones Alkyl aryl ethers Aralkylamines Fluorobenzenes Piperidines Aryl chlorides Aryl fluorides Para dioxins Trialkylamines Oxacyclic compounds Azacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzo-1,4-dioxane - Benzodioxane - Phenylpropylamine - Aryl ketone - Aryl alkyl ketone - Aralkylamine - Alkyl aryl ether - Fluorobenzene - Halobenzene - Piperidine - Aryl chloride - Para-dioxin - Aryl fluoride - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Oxacycle - Azacycle - Ether - Amine - Organohalogen compound - Organochloride - Organofluoride - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Primary 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