Compound Identification
SMILES
CC(=O)C1=CC=C(OCC(O)CN2CCC(CC2)NC2=NC3=CC=CC=C3N2CC2=CC=C(F)C=C2)C=C1
InChIKey
InChIKey=WSIORDLGIWQZTD-UHFFFAOYSA-N
Formula
C30H33FN4O3
Mass
516.617
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
-
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
Acetophenones Benzimidazoles Aryl alkyl ketones Phenoxy compounds Phenol ethers Benzoyl derivatives Secondary alkylarylamines Alkyl aryl ethers Fluorobenzenes Aminoimidazoles Piperidines Aryl fluorides N-substituted imidazoles Heteroaromatic compounds Secondary alcohols Trialkylamines 1,2-aminoalcohols Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Benzimidazole - Phenoxy compound - Phenol ether - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Halobenzene - Secondary aliphatic/aromatic amine - Fluorobenzene - Aminoimidazole - N-substituted imidazole - Piperidine - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Imidazole - 1,2-aminoalcohol - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Secondary amine - Ether - Organofluoride - Alcohol - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organonitrogen compound - Organic oxide - 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