Compound Identification
SMILES
C1SC2=CC=CC1=C2.CCC(=O)C1=CC(OC)=C(O)C=C1
InChIKey
InChIKey=ONVUXSYKWPTEIP-UHFFFAOYSA-N
Formula
C17H18O3S
Mass
302.39
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
Methoxyphenols Phenylpropanes Phenoxy compounds Methoxybenzenes Benzoyl derivatives Aryl alkyl ketones Anisoles Alkylarylthioethers Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Organoheterocyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Methoxyphenol - Phenylpropane - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Aryl alkyl ketone - Benzoyl - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Alkylarylthioether - Phenol - Monocyclic benzene moiety - Benzenoid - Organoheterocyclic compound - Thioether - Ether - Organic oxide - Hydrocarbon derivative - 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