Compound Identification
SMILES
[Fe].CC(=O)[C-]1C=CC=C1.CC(O)([C-]1[CH-][CH-][CH-][CH-]1)C1=CC=CC=C1
InChIKey
InChIKey=HRCWETDFEYPGNS-UHFFFAOYSA-N
Formula
C20H20FeO2
Mass
348.226
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 Aryl alkyl ketones
-
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
Direct Parent
Aryl alkyl ketones
Alternative Parents
Benzene and substituted derivatives Tertiary alcohols Organic transition metal salts Enolates Organic oxides Hydrocarbon derivatives Aromatic alcohols Organic anions
Molecular Framework
Not available
Substituents
Aryl alkyl ketone - Benzenoid - Monocyclic benzene moiety - Tertiary alcohol - Organic transition metal salt - Enolate - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Alcohol - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
External Descriptors
Not available