Compound Identification
SMILES
COC1=C2CC3=CC(=CC(CC4=C(OC)C(CC5=C(O)C(CC1=CC=C2)=CC(=C5)C(=O)CCCCCl)=CC=C4)=C3O)C(=O)CCCCCl
InChIKey
InChIKey=QYKHPFRUKDDXFL-UHFFFAOYSA-N
Formula
C40H42Cl2O6
Mass
689.67
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
Aryl alkyl ketones Anisoles Phenols Alkyl aryl ethers Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Butyrophenone - Anisole - Aryl alkyl ketone - Aryl ketone - Phenol ether - Alkyl aryl ether - Phenol - Ketone - Ether - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl chloride - Aromatic homopolycyclic 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