Compound Identification
SMILES
COC(=O)C1CC(=O)C2=C1C=C(OC)C=C2
InChIKey
InChIKey=GBHUTWQTQFIBLS-UHFFFAOYSA-N
Formula
C12H12O4
Mass
220.224
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 alkyl ketones Anisoles Alkyl aryl ethers Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Indanone - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Methyl ester - Carboxylic acid ester - Ketone - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - 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