Compound Identification
SMILES
CC1=C2C3=CC=CC=C3C(=O)C2=C(CBr)OS1(=O)=O
InChIKey
InChIKey=RUGGDSLNLDLGRK-UHFFFAOYSA-N
Formula
C13H9BrO4S
Mass
341.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Indanones
Intermediate Tree Nodes
Not available
Direct Parent
Indanones
Alternative Parents
Aryl ketones Sulfonic acid esters Oxathiins Organosulfonic acid esters Oxacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indanone - Aryl ketone - 1,2-oxathiin - Sulfonic acid ester - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Ketone - Oxacycle - Organoheterocyclic compound - Alkyl halide - Hydrocarbon derivative - Alkyl bromide - Organic oxide - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane ring bearing a ketone group.
External Descriptors
Not available