Compound Identification
SMILES
CC[C@H](CCOC1=C(C=C2CCC(=O)C2=C1)C1=CC=C(C=C1)C(F)(F)F)C(O)=O
InChIKey
InChIKey=JYZPENKCZHXULJ-CYBMUJFWSA-N
Formula
C22H21F3O4
Mass
406.401
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
Trifluoromethylbenzenes Phenol ethers Aryl alkyl ketones Alkyl aryl ethers Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Indanone - Trifluoromethylbenzene - Aryl alkyl ketone - Aryl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organohalogen compound - Organofluoride - Aromatic homopolycyclic 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