Compound Identification
SMILES
[Ti].CC[O-].CC[O-].O=C(CCCCCCCCC(=O)[CH-]C(=O)C1=CC=CC=C1)[CH-]C(=O)C1=CC=CC=C1
InChIKey
InChIKey=YZBYFXJRUHQLNU-UHFFFAOYSA-N
Formula
C30H38O6Ti
Mass
542.497
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
Benzoyl derivatives Aryl ketones Organic transition metal salts Enolates Organic oxides Hydrocarbon derivatives Alkoxides Organic anions
Molecular Framework
Not available
Substituents
Butyrophenone - Aryl ketone - Benzoyl - Ketone - Organic transition metal salt - Enolate - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alkoxide - Organooxygen compound - Carbonyl group - Organic anion - Aromatic homomonocyclic 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