Compound Identification
SMILES
COC(=O)CC1=C(C)\C(=C\C2=CC=C(C=C2)S(C)=O)C2=C1C=C(F)C=C2
InChIKey
InChIKey=QQHHBCZJIQNNSG-ZDLGFXPLSA-N
Formula
C21H19FO3S
Mass
370.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indenes and isoindenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indenes and isoindenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indenes and isoindenes
Alternative Parents
Phenyl sulfoxides Aryl fluorides Methyl esters Sulfoxides Sulfinyl compounds Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Phenyl sulfoxide - Indene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Methyl ester - Carboxylic acid ester - Sulfoxide - Carboxylic acid derivative - Sulfinyl compound - Monocarboxylic acid or derivatives - Organic oxide - Organosulfur compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as indenes and isoindenes. These are compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring).
External Descriptors
Not available